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

C13H11FN2O2 — CID 112708250

IUPACN-(2-fluoro-4-methylphenyl)-2-oxo-1H-pyridine-3-carboxamide
SMILESCc1ccc(NC(=O)c2ccc[nH]c2=O)c(F)c1
InChIInChI=1S/C13H11FN2O2/c1-8-4-5-11(10(14)7-8)16-13(18)9-3-2-6-15-12(9)17/h2-7H,1H3,(H,15,17)(H,16,18)
InChIKeyBHBHTKFDDSWJSQ-UHFFFAOYSA-N
MW246.24 g/mol
LogP2.07
Rot. Bonds2

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

N-(2-fluoro-4-methylphenyl)-2-oxo-1H-pyridine-3-carboxamide (PubChem CID 112708250) has the molecular formula C13H11FN2O2 and a molecular weight of 246.24 g/mol. Its IUPAC name is N-(2-fluoro-4-methylphenyl)-2-oxo-1H-pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(2-fluoro-4-methylphenyl)-2-oxo-1H-pyridine-3-carboxamide
PubChem CID112708250
Molecular FormulaC13H11FN2O2
Molecular Weight246.24 g/mol
Exact Mass246.08
IUPAC NameN-(2-fluoro-4-methylphenyl)-2-oxo-1H-pyridine-3-carboxamide
SMILESCc1ccc(NC(=O)c2ccc[nH]c2=O)c(F)c1
InChIInChI=1S/C13H11FN2O2/c1-8-4-5-11(10(14)7-8)16-13(18)9-3-2-6-15-12(9)17/h2-7H,1H3,(H,15,17)(H,16,18)
InChIKeyBHBHTKFDDSWJSQ-UHFFFAOYSA-N
XLogP2.07
TPSA61.96 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.24
LogP ≤ 52.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2,3-difluoro-N-(2-fluoro-4-methylphenyl)benzamide
CID 62648850
N-(2-fluoro-4-methylphenyl)-4-oxo-1H-pyridine-3-carboxamide
CID 103336940
N-(2-fluoro-4-methylphenyl)-2-hydroxy-4-methylbenzamide
CID 28881726
N-[2-(3-aminoprop-1-ynyl)-5-methylphenyl]-2-oxo-1H-pyridine-3-carboxamide
CID 82750300
N-(4-chloro-2-fluorophenyl)-2-fluoro-5-methylbenzamide
CID 55083427
N-(2-fluoro-4-methylphenyl)-2-nitrobenzamide
CID 26522920
3-amino-2-chloro-N-(2-fluoro-4-methylphenyl)benzamide
CID 112574577
N-(2,4-dimethoxyphenyl)-2-oxo-1H-pyridine-3-carboxamide
CID 18104674
N-(2-methyl-4-pyrrolidin-1-ylphenyl)-2-oxo-1H-pyridine-3-carboxamide
CID 17482365
N-(2-bromophenyl)-2-oxo-1H-pyridine-3-carboxamide
CID 43111877
N-(2,4-dimethylphenyl)-2-fluorobenzamide
CID 579639
2-amino-4-fluoro-N-(2-fluoro-4-methylphenyl)benzamide
CID 63109760

Frequently Asked Questions

What is the IUPAC name of N-(2-fluoro-4-methylphenyl)-2-oxo-1H-pyridine-3-carboxamide?
The IUPAC name of N-(2-fluoro-4-methylphenyl)-2-oxo-1H-pyridine-3-carboxamide (CID 112708250) is N-(2-fluoro-4-methylphenyl)-2-oxo-1H-pyridine-3-carboxamide.
What is the SMILES notation for N-(2-fluoro-4-methylphenyl)-2-oxo-1H-pyridine-3-carboxamide?
The canonical SMILES for N-(2-fluoro-4-methylphenyl)-2-oxo-1H-pyridine-3-carboxamide is Cc1ccc(NC(=O)c2ccc[nH]c2=O)c(F)c1.
What is the InChIKey of N-(2-fluoro-4-methylphenyl)-2-oxo-1H-pyridine-3-carboxamide?
The InChIKey is BHBHTKFDDSWJSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11FN2O2/c1-8-4-5-11(10(14)7-8)16-13(18)9-3-2-6-15-12(9)17/h2-7H,1H3,(H,15,17)(H,16,18).
What are the key properties of N-(2-fluoro-4-methylphenyl)-2-oxo-1H-pyridine-3-carboxamide?
N-(2-fluoro-4-methylphenyl)-2-oxo-1H-pyridine-3-carboxamide has a molecular weight of 246.24 g/mol, XLogP of 2.07, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-fluoro-4-methylphenyl)-2-oxo-1H-pyridine-3-carboxamide is sourced from PubChem (CID 112708250), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).