6-methyl-N-(2-methylsulfanylphenyl)-2-oxo-1H-pyridine-3-carboxamide

C14H14N2O2S — CID 87009467

IUPAC6-methyl-N-(2-methylsulfanylphenyl)-2-oxo-1H-pyridine-3-carboxamide
SMILESCSc1ccccc1NC(=O)c1ccc(C)[nH]c1=O
InChIInChI=1S/C14H14N2O2S/c1-9-7-8-10(13(17)15-9)14(18)16-11-5-3-4-6-12(11)19-2/h3-8H,1-2H3,(H,15,17)(H,16,18)
InChIKeyBKKFJWNFEOVJHY-UHFFFAOYSA-N
MW274.35 g/mol
LogP2.66
Rot. Bonds3

About 6-methyl-N-(2-methylsulfanylphenyl)-2-oxo-1H-pyridine-3-carboxamide

6-methyl-N-(2-methylsulfanylphenyl)-2-oxo-1H-pyridine-3-carboxamide (PubChem CID 87009467) has the molecular formula C14H14N2O2S and a molecular weight of 274.35 g/mol. Its IUPAC name is 6-methyl-N-(2-methylsulfanylphenyl)-2-oxo-1H-pyridine-3-carboxamide.

Molecular Properties

Compound Name6-methyl-N-(2-methylsulfanylphenyl)-2-oxo-1H-pyridine-3-carboxamide
PubChem CID87009467
Molecular FormulaC14H14N2O2S
Molecular Weight274.35 g/mol
Exact Mass274.08
IUPAC Name6-methyl-N-(2-methylsulfanylphenyl)-2-oxo-1H-pyridine-3-carboxamide
SMILESCSc1ccccc1NC(=O)c1ccc(C)[nH]c1=O
InChIInChI=1S/C14H14N2O2S/c1-9-7-8-10(13(17)15-9)14(18)16-11-5-3-4-6-12(11)19-2/h3-8H,1-2H3,(H,15,17)(H,16,18)
InChIKeyBKKFJWNFEOVJHY-UHFFFAOYSA-N
XLogP2.66
TPSA61.96 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.35
LogP ≤ 52.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-[(2R)-2-cyanopropyl]sulfanylphenyl]-6-methyl-2-oxo-1H-pyridine-3-carboxamide
CID 95135064
N-(3-chloro-4-methylsulfanylphenyl)-6-methyl-2-oxo-1H-pyridine-3-carboxamide
CID 71865261
N-(3-formyl-2-methylphenyl)-6-methyl-2-oxo-1H-pyridine-3-carboxamide
CID 90105569
2-iodo-N-(2-methylsulfanylphenyl)benzamide
CID 1250224
2-iodo-3-methyl-N-(2-methylsulfanylphenyl)benzamide
CID 47188193
2-methyl-N-(2-methylsulfanylphenyl)furan-3-carboxamide
CID 1243990
5-methyl-2-[(6-methyl-2-oxo-1H-pyridine-3-carbonyl)amino]benzoic acid
CID 115596430
4-methyl-3-[(6-methyl-2-oxo-1H-pyridine-3-carbonyl)amino]benzoic acid
CID 115590008
3-amino-2-methyl-N-(2-methylsulfanylphenyl)benzamide
CID 61117271
N-(2-ethylsulfanylphenyl)-2-methylsulfanylbenzamide
CID 28577649
N-(4-bromo-2,6-difluorophenyl)-6-methyl-2-oxo-1H-pyridine-3-carboxamide
CID 115666671
4-amino-2-chloro-N-(2-methylsulfanylphenyl)benzamide
CID 61117159

Frequently Asked Questions

What is the IUPAC name of 6-methyl-N-(2-methylsulfanylphenyl)-2-oxo-1H-pyridine-3-carboxamide?
The IUPAC name of 6-methyl-N-(2-methylsulfanylphenyl)-2-oxo-1H-pyridine-3-carboxamide (CID 87009467) is 6-methyl-N-(2-methylsulfanylphenyl)-2-oxo-1H-pyridine-3-carboxamide.
What is the SMILES notation for 6-methyl-N-(2-methylsulfanylphenyl)-2-oxo-1H-pyridine-3-carboxamide?
The canonical SMILES for 6-methyl-N-(2-methylsulfanylphenyl)-2-oxo-1H-pyridine-3-carboxamide is CSc1ccccc1NC(=O)c1ccc(C)[nH]c1=O.
What is the InChIKey of 6-methyl-N-(2-methylsulfanylphenyl)-2-oxo-1H-pyridine-3-carboxamide?
The InChIKey is BKKFJWNFEOVJHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N2O2S/c1-9-7-8-10(13(17)15-9)14(18)16-11-5-3-4-6-12(11)19-2/h3-8H,1-2H3,(H,15,17)(H,16,18).
What are the key properties of 6-methyl-N-(2-methylsulfanylphenyl)-2-oxo-1H-pyridine-3-carboxamide?
6-methyl-N-(2-methylsulfanylphenyl)-2-oxo-1H-pyridine-3-carboxamide has a molecular weight of 274.35 g/mol, XLogP of 2.66, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-N-(2-methylsulfanylphenyl)-2-oxo-1H-pyridine-3-carboxamide is sourced from PubChem (CID 87009467), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).