NCT

(S)-3-(1-METHYLPYRROLIDIN-2-YL)PYRIDINE

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is present as a standalone ligand in 20 entries

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Chemical Component Summary
Name	(S)-3-(1-METHYLPYRROLIDIN-2-YL)PYRIDINE
Synonyms	(S)-(-)-NICOTINE; 3-[(2S)-1-METHYL-2-PYRROLIDINYL] PYRIDINE
Identifiers	3-[(1R,2S)-1-methylpyrrolidin-2-yl]pyridine
Formula	C₁₀ H₁₄ N₂
Molecular Weight	162.232
Type	NON-POLYMER
Isomeric SMILES	C[N@@]1CCC[C@H]1c2cccnc2
InChI	InChI=1S/C10H14N2/c1-12-7-3-5-10(12)9-4-2-6-11-8-9/h2,4,6,8,10H,3,5,7H2,1H3/t10-/m0/s1
InChIKey	SNICXCGAKADSCV-JTQLQIEISA-N

Chemical Details
Formal Charge	0
Atom Count	26
Chiral Atom Count	1
Bond Count	27
Aromatic Bond Count	6

Drug Info: DrugBank

DrugBank ID	DB00184
Name	Nicotine
Groups	approved
Description	Nicotine is highly toxic alkaloid. It is the prototypical agonist at nicotinic cholinergic receptors where it dramatically stimulates neurons and ultimately blocks synaptic transmission. Nicotine is also important medically because of its presence in tobacco smoke.
Synonyms	L(−)-nicotine Nikotin Nicotine 3-(2-(N-methylpyrrolidinyl))pyridine Nicotine polacrilex (−)-nicotine (S)-Nicotine Nicotine bitartrate dihydrate (S)-3-(1-methylpyrrolidin-2-yl)pyridine Nicotine bitartrate Nikotyna 3-(N-methylpyrollidino)pyridine (S)-3-(N-methylpyrrolidin-2-yl)pyridine Nicotina Nicotine betadex (S)-(−)-nicotine
Brand Names	Nicoderm Trd 114mg Nicotine/21 Stop Smoking Aid Good Sense Nicotine Nicotac Nicotine Polacrilex Coated Cinnamon Topcare Nicotine Gum Nicotine Polacrilex, Original Nicorette White Ice Mint Kirkland Signature Nicotine Habitrol Patch Nicotine Transdermal System, Step 2 Nicorette 4mg Cinnamon Surge Rexall Nicotine Nicotine Gum Humana Pharmacy Nicotine Harris Teeter Nicotine Habitrol Patch Nicotine Transdermal System, Step 1 Nicotine Tartrate Good Neighbor Pharmacy Nicotine Mini Nicotine Polacrilex, Coated Mint Flavor Topcare Nicotine Polacrilex Nicotine Polacrilex Gum Good Sense Nicotine UN1654 Sunmark Nicotine Transdermal System Step 3 Nicotine transdermal system step 3 Zonnic Nicotine Nicoderm Trd 78mg Nicotine/14 Nicotine Coated Fruit Flavor Signature Care Nicotine Meijer NICOTINE TRANSDERMAL SYSTEM STEP 2 Nicoderm Cq Nicotine Polacrilex coated ice mint Sunmark Nicotine Transdermal System Step 2 Nicotine Mini Nicotine Polacrilex MINT Nicorette Spearmint Burst Up and Up Cherry Nicotine In control nicotine in control Nicotine Sunmark Nicotine Preferred Plus Nicotine Polacrilex Gum, Original Flavor Nicotine Transdermal Patches Tru Relief Nicotine Nicotine Resinate Exchange Select Nicotine Transdermal System Step 3 Nicotine Polacrilex original Nicorette Cinnamon Surge Medline CareOne Nicotine Transdermal System Step 3 Nicorette Gum 2mg Kroger Nicotine Transdermal System Step 2 Stop Smoking Aid Nicotine Healthmart Nicotine Transdermal System Step 2 Kirkland Signature Quit 4 Nicotine Lozenge Nicotine Transdermal System Habitrol Lozenge Cherry Leader Nicotine Transdermal System Step 2 Meijer NICOTINE TRANSDERMAL SYSTEM Step 3 Sunmark Nicotine Transdermal System Step 1 Up and Up nicotine Nicotine Transdermal System Step 2 Habitrol Step 2 Healthmart Nicotine Transdermal System Step 3 Members Mark Mini Nicotine Nicotine mini Safeway Nicotine Transdermal System Step 2 equate Nicotine Equaline nicotine Sound Body Nicotine Nicotine Polacrilex coated mint Nicotine Polacrilex Coated Mint Basic Care nicotine Up and Up Mini Nicotine HEB Nicotine Nicorette Invisipatch CareOne nicotine Preferred Plus Nicotine Nicotine Polacrilex coated cinnamon Leader Nicotine Transdermal System Step 3 Equaline Nicotine Transdermal System Step 1 Nicorette Fresh Mint Healthmart Nicotine Transdermal System Step 1 Nicorette 4mg White Ice Mint Gum, Lil Drug Store Careone Nicotine Polacrilex Rugby Nicotine Polacrilex Gum, Mint Flavor Smart Sense Nicotine Mint Smart Sense Nicotine Polacrilex Careone Nicotine Zonnic Nicotine Mini Topcare Nicotine Rite Aid Nicotine Transdermal System Step 2 Up and Up Nicotine Polacrilex Equate Nicotine Habitrol Patch Nicotine Transdermal System, Step 3 Habitrol Step 3 Nicorette and Aquafresh Fruit Chill and Extreme Clean Whitening Nicorette Original Nicotine Coated Mint Rugby Nicotine Polacrilex Gum, Coated Fruit Flavor Zonnic nicotine Euqate Nicotine Smart Sense Nicotine Exchange Select Nicotine Good Sense Nicotine Stop Smoking Aid Nicotine transdermal Berkley and Jensen Nicotine Meijer NICOTINE TRANSDERMAL SYSTEM Step 1 Nicorette Plus 4mg Health Mart Nicotine Polacrilex Nicorette Fruit Chill Nicotine Transdermal System Step 1 Rite Aid Nicotine Transdermal System Step 1 CareOne Nicotine Transdermal System Step 2 Thrive Up and Up Mini Nicotine Polacrilex Kirkland Signature Quit 2 Nicorette White Mint nicotine polacrilex Leader Nicotine Transdermal System Step 1 Mini Nicotine Nicotine Polacrilex Coated Fruit Nicorette Nicotine Polacrilex Origianl Flavor Up and Up Nicotine NICOTINE Transdermal System Step 3 Nicorette Fruit Chill nicotine polacrilex Nicotine Polacrilex Stop Smoking Aid Equaline Nicotine Nicotine Polacrilex Original Flavor CareOne Mini Nicotine Polacrilex Safeway Nicotine Transdermal System Step 3 Kroger Nicotine Transdermal System Step 1 Health Mart Nicotine Nicotine transdermal system members mark Nicotine Nicotine Stop Smoking Aid Nicotine Polacrilex coated fruit Nicorelief Berkley and Jensen Nicotine Polacrilex Rugby Nicotine Dg Health Nicotine Nicorette Mint Basic Care Nicotine Nicotine polacrilex CareOne Nicotine Good Neighbor Pharmacy Nicotine Basic Care Nicotine Mini Members Mark Nicotine Habitrol Lozenge Original Flavor Nicotac Nicotine Polacrilex Coated Mint Care One Nicotine Nicotac Nicotine Polacrilex Coated Fruit CareOne Nicotine Transdermal System Step 1 Family Wellness Nicotine Berkley and Jensen nicotine Nicotine transdermal system step 2 Nicotrol Nicorette Cinnamon Surge nicotine polacrilex Nicotine transdermal system step 1 Simply Right Nicotine Commit Blip Healthy Accents Nicotine Nicotine Polacrilex Coated Ice Mint Bjwc Nicotine Nicotine Transdermal Nicotrol (Professional Sample) Nicotine Sugar Free Health Mart nicotine polacrilex American Fare Nicotine Transdermal System Lucy nicotine Nicotine Polacrilex Lozenge Mint Rugby Nicotine Polacrilex Gum, Coated Mint Flavor Habitrol Nicotine Polacrilex Lozenge Mint Equate nicotine NICOTINE Original Maxi Nicotine In Control Nicotine Berkley and Jensen NICOTINE Habitrol Step 1 Topcare nicotine stop smoking aid Nicoderm Trd 36mg Nicotine/7 Sqcm Patch Zonnic Nicotine Polacrilex Nictoine Gum Safeway Nicotine Transdermal System Step 1 Nicotine Transdermal System Step 3 Topcare nicotine Lucy Nicotine Nicorette 4mg Fruit Chill Gum, Lil Drug Store NICOTINE Transdermal System Step 2 Nicotine COATED ice mint Rite Aid Nicotine Transdermal System Step 3 Foster and Thrive Nicotine TopCare Nicotine Nicotine Polacrilex Original Good Sense Nicotine Mint DG Health nicotine Nicotine Nicotine Polacrilex, Coated Fruit Flavor Rugby Nicotine Polacrilex Gum, Original Flavor Leader Nicotine Kroger Nicotine Transdermal System Step 3 Zonnic Up and Up Cherry Ice Nicotine Nicotine Mint Flavor NICOTINE Transdermal System Step 1 Nicotine Polacrilex
Indication	For the relief of nicotine withdrawal symptoms and as an aid to smoking cessation.
Categories	Agents producing tachycardia Alkaloids Autonomic Agents Cholinergic Agents Cholinergic Agonists Cholinergic Nicotinic Agonist Cytochrome P-450 CYP1A2 Inducers Cytochrome P-450 CYP1A2 Inducers (strength unknown) Cytochrome P-450 CYP1A2 Substrates Cytochrome P-450 CYP2A6 Inhibitors Cytochrome P-450 CYP2A6 Inhibitors (strength unknown) Cytochrome P-450 CYP2A6 Substrates Cytochrome P-450 CYP2B6 Substrates Cytochrome P-450 CYP2C19 Substrates Cytochrome P-450 CYP2C8 Substrates Cytochrome P-450 CYP2C9 Substrates Cytochrome P-450 CYP2D6 Substrates Cytochrome P-450 CYP2E1 Inducers Cytochrome P-450 CYP2E1 Inducers (strength unknown) Cytochrome P-450 CYP2E1 Inhibitors Cytochrome P-450 CYP2E1 Inhibitors (strength unknown) Cytochrome P-450 CYP2E1 Substrates Cytochrome P-450 CYP3A Substrates Cytochrome P-450 CYP3A4 Substrates Cytochrome P-450 Enzyme Inducers Cytochrome P-450 Enzyme Inhibitors Cytochrome P-450 Substrates Drugs Used in Addictive Disorders Drugs Used in Nicotine Dependence Ganglion Blockers Ganglionic Stimulants Miscellaneous Autonomic Drugs Monoamine Oxidase A Inhibitors for interaction with Monoamine Oxidase A substrates Nervous System Neurotransmitter Agents Nicotine, antagonists & inhibitors Nicotinic Agonists OCT1 inhibitors OCT2 Inhibitors Peripheral Nervous System Agents Pyridines Smoking Cessation Agents Solanaceous Alkaloids
ATC-Code	N07BA01
CAS number	54-11-5

Drug Targets

Name	Target Sequence	Pharmacological Action	Actions
Neuronal acetylcholine receptor subunit alpha-4	MELGGPGAPRLLPPLLLLLGTGLLRASSHVETRAHAEERLLKKLFSGYNK...	unknown	agonist
Neuronal acetylcholine receptor subunit alpha-7	MRCSPGGVWLALAASLLHVSLQGEFQRKLYKELVKNYNPLERPVANDSQP...	unknown	agonist
Neuronal acetylcholine receptor subunit beta-2	MARRCGPVALLLGFGLLRLCSGVWGTDTEERLVEHLLDPSRYNKLIRPAT...	unknown	agonist
Neuronal acetylcholine receptor subunit alpha-2	MGPSCPVFLSFTKLSLWWLLLTPAGGEEAKRPPPRAPGDPLSSPSPTALP...	unknown	agonist
Neuronal acetylcholine receptor subunit alpha-3	MGSGPLSLPLALSPPRLLLLLLLSLLPVARASEAEHRLFERLFEDYNEII...	unknown	agonist
Neuronal acetylcholine receptor subunit alpha-5	MAARGSGPRALRLLLLVQLVAGRCGLAGAAGGAQRGLSEPSSIAKHEDSL...	unknown	agonist
Neuronal acetylcholine receptor subunit alpha-6	MLTSKGQGFLHGGLCLWLCVFTPFFKGCVGCATEERLFHKLFSHYNQFIR...	unknown	agonist
Neuronal acetylcholine receptor subunit alpha-9	MNWSHSCISFCWIYFAASRLRAAETADGKYAQKLFNDLFEDYSNALRPVE...	unknown	agonist
Neuronal acetylcholine receptor subunit alpha-10	MGLRSHHLSLGLLLLFLLPAECLGAEGRLALKLFRDLFANYTSALRPVAD...	unknown	agonist
Neuronal acetylcholine receptor subunit beta-3	MLPDFMLVLIVLGIPSSATTGFNSIAENEDALLRHLFQGYQKWVRPVLHS...	unknown	agonist
Neuronal acetylcholine receptor subunit beta-4	MRRAPSLVLFFLVALCGRGNCRVANAEEKLMDDLLNKTRYNNLIRPATSS...	unknown	agonist
Cytochrome P450 19A1	MVLEMLNPIHYNITSIVPEAMPAATMPVLLLTGLFLLVWNYEGTSSIPGP...	unknown	inhibitor
Choline O-acetyltransferase	MGLRTAKKRGLGGGGKWKREEGGGTRGRREVRPACFLQSGGRGDPGDVGG...	unknown	inhibitor
Cytochrome P450 1A1	MLFPISMSATEFLLASVIFCLVFWVIRASRPQVPKGLKNPPGPWGWPLIG...	unknown	substrate,inducer
Cytochrome P450 1A2	MALSQSVPFSATELLLASAIFCLVFWVLKGLRPRVPKGLKSPPEPWGWPL...	unknown	substrate,inducer
Cytochrome P450 2C19	MDPFVVLVLCLSCLLLLSIWRQSSGRGKLPPGPTPLPVIGNILQIDIKDV...	unknown	substrate
Cytochrome P450 2C8	MEPFVVLVLCLSFMLLFSLWRQSCRRRKLPPGPTPLPIIGNMLQIDVKDI...	unknown	substrate
Cytochrome P450 2C9	MDSLVVLVLCLSCLLLLSLWRQSSGRGKLPPGPTPLPVIGNILQIGIKDI...	unknown	substrate
Cytochrome P450 2D6	MGLEALVPLAVIVAIFLLLVDLMHRRQRWAARYPPGPLPLPGLGNLLHVD...	unknown	substrate
Cytochrome P450 3A4	MALIPDLAMETWLLLAVSLVLLYLYGTHSHGLFKKLGIPGPTPLPFLGNI...	unknown	substrate
Amine oxidase [flavin-containing] A	MENQEKASIAGHMFDVVVIGGGISGLSAAKLLTEYGVSVLVLEARDRVGG...	unknown	inhibitor
Amine oxidase [flavin-containing] B	MSNKCDVVVVGGGISGMAAAKLLHDSGLNVVVLEARDRVGGRTYTLRNQK...	unknown	inhibitor
Cytochrome P450 2A6	MLASGMLLVALLVCLTVMVLMSVWQQRKSKGKLPPGPTPLPFIGNYLQLN...	unknown	substrate,inhibitor
Cytochrome P450 2E1	MSALGVTVALLVWAAFLLLVSMWRQVHSSWNLPPGPFPLPIIGNLFQLEL...	unknown	substrate,inhibitor,inducer
Cytochrome P450 2A13	MLASGLLLVTLLACLTVMVLMSVWRQRKSRGKLPPGPTPLPFIGNYLQLN...	unknown	substrate
Cytochrome P450 2B6	MELSVLLFLALLTGLLLLLVQRHPNTHDRLPPGPRPLPLLGNLLQMDRRG...	unknown	substrate
Solute carrier family 22 member 2	MPTTVDDVLEHGGEFHFFQKQMFFLLALLSATFAPIYVGIVFLGFTPDHR...	unknown	inhibitor
Solute carrier family 22 member 1	MPTVDDILEQVGESGWFQKQAFLILCLLSAAFAPICVGIVFLGFTPDHHC...	unknown	inhibitor
Solute carrier family 22 member 3	MPSFDEALQRVGEFGRFQRRVFLLLCLTGVTFAFLFVGVVFLGTQPDHYW...	unknown	inhibitor
Solute carrier family 22 member 5	MRDYDEVTAFLGEWGPFQRLIFFLLSASIIPNGFTGLSSVFLIATPEHRC...	unknown	inhibitor
Solute carrier family 22 member 4	MRDYDEVIAFLGEWGPFQRLIFFLLSASIIPNGFNGMSVVFLAGTPEHRC...	unknown	inhibitor
View More

Drug Info/Drug Targets: DrugBank 3.0: a comprehensive resource for 'omics' research on drugs. Knox C, Law V, Jewison T, Liu P, Ly S, Frolkis A, Pon A, Banco K, Mak C, Neveu V, Djoumbou Y, Eisner R, Guo AC, Wishart DS. Nucleic Acids Res. 2011 Jan; 39 (Database issue):D1035-41. | PMID:21059682