N83

~{N}-pyridin-3-ylprop-2-enamide

Created:	2022-08-12
Last modified:	2023-09-23

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1 entries where N83 is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	19
Chiral Atom Count	0
Bond Count	19
Aromatic Bond Count	6

2D diagram of N83

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Chemical Component Summary
Name	~{N}-pyridin-3-ylprop-2-enamide
Systematic Name (OpenEye OEToolkits)	~{N}-pyridin-3-ylprop-2-enamide
Formula	C₈ H₈ N₂ O
Molecular Weight	148.162
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	CACTVS	3.385	C=CC(=O)Nc1cccnc1
SMILES	OpenEye OEToolkits	2.0.7	C=CC(=O)Nc1cccnc1
Canonical SMILES	CACTVS	3.385	C=CC(=O)Nc1cccnc1
Canonical SMILES	OpenEye OEToolkits	2.0.7	C=CC(=O)Nc1cccnc1
InChI	InChI	1.06	InChI=1S/C8H8N2O/c1-2-8(11)10-7-4-3-5-9-6-7/h2-6H,1H2,(H,10,11)
InChIKey	InChI	1.06	RMJWTHQXDHWUKO-UHFFFAOYSA-N

Related Resource References

Resource Name	Reference
PubChem	43616243
ChEMBL	CHEMBL3309327

RCSB PDB Core Operations are funded by the U.S. National Science Foundation (DBI-2321666), the US Department of Energy (DE-SC0019749), and the National Cancer Institute, National Institute of Allergy and Infectious Diseases, and National Institute of General Medical Sciences of the National Institutes of Health under grant R01GM157729.