N-(2-methylphenyl)-4-oxo-1H-pyridine-3-carboxamide

C13H12N2O2 — CID 23633101

IUPACN-(2-methylphenyl)-4-oxo-1H-pyridine-3-carboxamide
SMILESCc1ccccc1NC(=O)c1c[nH]ccc1=O
InChIInChI=1S/C13H12N2O2/c1-9-4-2-3-5-11(9)15-13(17)10-8-14-7-6-12(10)16/h2-8H,1H3,(H,14,16)(H,15,17)
InChIKeyLFBRIKVSDXKMBY-UHFFFAOYSA-N
MW228.25 g/mol
LogP1.94
Rot. Bonds2

About N-(2-methylphenyl)-4-oxo-1H-pyridine-3-carboxamide

N-(2-methylphenyl)-4-oxo-1H-pyridine-3-carboxamide (PubChem CID 23633101) has the molecular formula C13H12N2O2 and a molecular weight of 228.25 g/mol. Its IUPAC name is N-(2-methylphenyl)-4-oxo-1H-pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(2-methylphenyl)-4-oxo-1H-pyridine-3-carboxamide
PubChem CID23633101
Molecular FormulaC13H12N2O2
Molecular Weight228.25 g/mol
Exact Mass228.09
IUPAC NameN-(2-methylphenyl)-4-oxo-1H-pyridine-3-carboxamide
SMILESCc1ccccc1NC(=O)c1c[nH]ccc1=O
InChIInChI=1S/C13H12N2O2/c1-9-4-2-3-5-11(9)15-13(17)10-8-14-7-6-12(10)16/h2-8H,1H3,(H,14,16)(H,15,17)
InChIKeyLFBRIKVSDXKMBY-UHFFFAOYSA-N
XLogP1.94
TPSA61.96 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.25
LogP ≤ 51.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(5-bromo-2-methylphenyl)-4-oxo-1H-pyridine-3-carboxamide
CID 103337253
N-(2-fluoro-4-methylphenyl)-4-oxo-1H-pyridine-3-carboxamide
CID 103336940
N-(2-methylphenyl)-2-(propan-2-ylamino)benzamide
CID 63107622
N-(4-bromophenyl)-4-oxo-1H-pyridine-3-carboxamide
CID 23633098
N-(5-amino-2-fluorophenyl)-4-oxo-1H-pyridine-3-carboxamide
CID 114038625
N-(2-methylphenyl)-1H-pyrrole-2-carboxamide
CID 47009571
2,5-dimethyl-N-(2-methylphenyl)benzamide
CID 925354
3-hydroxy-2-methyl-N-(2-methylphenyl)benzamide
CID 82786919
5-methyl-N-(2-methylphenyl)-1,2-oxazole-4-carboxamide
CID 850304
1,2,5-trimethyl-N-(2-methylphenyl)pyrrole-3-carboxamide
CID 9182741
N-benzyl-4-oxo-1H-pyridine-3-carboxamide
CID 23633090
2-[2-[(2-methylphenyl)carbamoyl]phenyl]benzoic acid
CID 777419

Frequently Asked Questions

What is the IUPAC name of N-(2-methylphenyl)-4-oxo-1H-pyridine-3-carboxamide?
The IUPAC name of N-(2-methylphenyl)-4-oxo-1H-pyridine-3-carboxamide (CID 23633101) is N-(2-methylphenyl)-4-oxo-1H-pyridine-3-carboxamide.
What is the SMILES notation for N-(2-methylphenyl)-4-oxo-1H-pyridine-3-carboxamide?
The canonical SMILES for N-(2-methylphenyl)-4-oxo-1H-pyridine-3-carboxamide is Cc1ccccc1NC(=O)c1c[nH]ccc1=O.
What is the InChIKey of N-(2-methylphenyl)-4-oxo-1H-pyridine-3-carboxamide?
The InChIKey is LFBRIKVSDXKMBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H12N2O2/c1-9-4-2-3-5-11(9)15-13(17)10-8-14-7-6-12(10)16/h2-8H,1H3,(H,14,16)(H,15,17).
What are the key properties of N-(2-methylphenyl)-4-oxo-1H-pyridine-3-carboxamide?
N-(2-methylphenyl)-4-oxo-1H-pyridine-3-carboxamide has a molecular weight of 228.25 g/mol, XLogP of 1.94, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methylphenyl)-4-oxo-1H-pyridine-3-carboxamide is sourced from PubChem (CID 23633101), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).