A1CUD

N-(2-fluorophenyl)pyridine-3-carboxamide

Created:	2025-09-18
Last modified:	2026-02-18

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1 entries where A1CUD is found as a standalone ligand

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Chemical Details
Formal Charge	0
Atom Count	25
Chiral Atom Count	0
Bond Count	26
Aromatic Bond Count	12

2D diagram of A1CUD

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Chemical Component Summary
Name	N-(2-fluorophenyl)pyridine-3-carboxamide
Systematic Name (OpenEye OEToolkits)	~{N}-(2-fluorophenyl)pyridine-3-carboxamide
Formula	C₁₂ H₉ F N₂ O
Molecular Weight	216.211
Type	NON-POLYMER

Chemical Descriptors
Type	Program	Version	Descriptor
SMILES	ACDLabs	14.52	O=C(Nc1ccccc1F)c1cccnc1
SMILES	CACTVS	3.385	Fc1ccccc1NC(=O)c2cccnc2
SMILES	OpenEye OEToolkits	3.1.0.0	c1ccc(c(c1)NC(=O)c2cccnc2)F
Canonical SMILES	CACTVS	3.385	Fc1ccccc1NC(=O)c2cccnc2
Canonical SMILES	OpenEye OEToolkits	3.1.0.0	c1ccc(c(c1)NC(=O)c2cccnc2)F
InChI	InChI	1.06	InChI=1S/C12H9FN2O/c13-10-5-1-2-6-11(10)15-12(16)9-4-3-7-14-8-9/h1-8H,(H,15,16)
InChIKey	InChI	1.06	NFDGKRRKIIFBAB-UHFFFAOYSA-N

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.