N-(4-cyanophenyl)-6-oxo-1H-pyridine-3-carboxamide

C13H9N3O2 — CID 8015151

IUPACN-(4-cyanophenyl)-6-oxo-1H-pyridine-3-carboxamide
SMILESN#Cc1ccc(NC(=O)c2ccc(=O)[nH]c2)cc1
InChIInChI=1S/C13H9N3O2/c14-7-9-1-4-11(5-2-9)16-13(18)10-3-6-12(17)15-8-10/h1-6,8H,(H,15,17)(H,16,18)
InChIKeyFIKFESNXBAMZBJ-UHFFFAOYSA-N
MW239.23 g/mol
LogP1.50
Rot. Bonds2

About N-(4-cyanophenyl)-6-oxo-1H-pyridine-3-carboxamide

N-(4-cyanophenyl)-6-oxo-1H-pyridine-3-carboxamide (PubChem CID 8015151) has the molecular formula C13H9N3O2 and a molecular weight of 239.23 g/mol. Its IUPAC name is N-(4-cyanophenyl)-6-oxo-1H-pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(4-cyanophenyl)-6-oxo-1H-pyridine-3-carboxamide
PubChem CID8015151
Molecular FormulaC13H9N3O2
Molecular Weight239.23 g/mol
Exact Mass239.07
IUPAC NameN-(4-cyanophenyl)-6-oxo-1H-pyridine-3-carboxamide
SMILESN#Cc1ccc(NC(=O)c2ccc(=O)[nH]c2)cc1
InChIInChI=1S/C13H9N3O2/c14-7-9-1-4-11(5-2-9)16-13(18)10-3-6-12(17)15-8-10/h1-6,8H,(H,15,17)(H,16,18)
InChIKeyFIKFESNXBAMZBJ-UHFFFAOYSA-N
XLogP1.50
TPSA85.75 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.23
LogP ≤ 51.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-fluorophenyl)-6-oxo-1H-pyridine-3-carboxamide
CID 8745096
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CID 109049994
N-(4-cyanophenyl)-4-hydrazinylbenzamide
CID 55052706
4-cyano-N-[4-(trifluoromethyl)phenyl]benzamide
CID 2684239
1-N-(4-cyanophenyl)-4-N-(4-methoxyphenyl)benzene-1,4-dicarboxamide
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N-(4-cyanophenyl)-4-(2-methylpropanoylamino)benzamide
CID 977438
N-(1,3-dioxoisoindol-5-yl)-6-oxo-1H-pyridine-3-carboxamide
CID 28834338
6-oxo-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)-1H-pyridine-3-carboxamide
CID 26017164
6-oxo-N-(4-pentylphenyl)-1H-pyridine-3-carboxamide
CID 60630583
4-N-(2-cyanophenyl)-1-N-(4-cyanophenyl)benzene-1,4-dicarboxamide
CID 109050250
N-(4-cyanophenyl)furan-3-carboxamide
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Frequently Asked Questions

What is the IUPAC name of N-(4-cyanophenyl)-6-oxo-1H-pyridine-3-carboxamide?
The IUPAC name of N-(4-cyanophenyl)-6-oxo-1H-pyridine-3-carboxamide (CID 8015151) is N-(4-cyanophenyl)-6-oxo-1H-pyridine-3-carboxamide.
What is the SMILES notation for N-(4-cyanophenyl)-6-oxo-1H-pyridine-3-carboxamide?
The canonical SMILES for N-(4-cyanophenyl)-6-oxo-1H-pyridine-3-carboxamide is N#Cc1ccc(NC(=O)c2ccc(=O)[nH]c2)cc1.
What is the InChIKey of N-(4-cyanophenyl)-6-oxo-1H-pyridine-3-carboxamide?
The InChIKey is FIKFESNXBAMZBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H9N3O2/c14-7-9-1-4-11(5-2-9)16-13(18)10-3-6-12(17)15-8-10/h1-6,8H,(H,15,17)(H,16,18).
What are the key properties of N-(4-cyanophenyl)-6-oxo-1H-pyridine-3-carboxamide?
N-(4-cyanophenyl)-6-oxo-1H-pyridine-3-carboxamide has a molecular weight of 239.23 g/mol, XLogP of 1.50, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-cyanophenyl)-6-oxo-1H-pyridine-3-carboxamide is sourced from PubChem (CID 8015151), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).