N-(2-chloro-4-methylphenyl)-6-methyl-4-oxo-1H-pyridine-3-carboxamide

C14H13ClN2O2 — CID 103696175

IUPACN-(2-chloro-4-methylphenyl)-6-methyl-4-oxo-1H-pyridine-3-carboxamide
SMILESCc1ccc(NC(=O)c2c[nH]c(C)cc2=O)c(Cl)c1
InChIInChI=1S/C14H13ClN2O2/c1-8-3-4-12(11(15)5-8)17-14(19)10-7-16-9(2)6-13(10)18/h3-7H,1-2H3,(H,16,18)(H,17,19)
InChIKeyYBNSRYNVOWYPEW-UHFFFAOYSA-N
MW276.72 g/mol
LogP2.90
Rot. Bonds2

About N-(2-chloro-4-methylphenyl)-6-methyl-4-oxo-1H-pyridine-3-carboxamide

N-(2-chloro-4-methylphenyl)-6-methyl-4-oxo-1H-pyridine-3-carboxamide (PubChem CID 103696175) has the molecular formula C14H13ClN2O2 and a molecular weight of 276.72 g/mol. Its IUPAC name is N-(2-chloro-4-methylphenyl)-6-methyl-4-oxo-1H-pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(2-chloro-4-methylphenyl)-6-methyl-4-oxo-1H-pyridine-3-carboxamide
PubChem CID103696175
Molecular FormulaC14H13ClN2O2
Molecular Weight276.72 g/mol
Exact Mass276.07
IUPAC NameN-(2-chloro-4-methylphenyl)-6-methyl-4-oxo-1H-pyridine-3-carboxamide
SMILESCc1ccc(NC(=O)c2c[nH]c(C)cc2=O)c(Cl)c1
InChIInChI=1S/C14H13ClN2O2/c1-8-3-4-12(11(15)5-8)17-14(19)10-7-16-9(2)6-13(10)18/h3-7H,1-2H3,(H,16,18)(H,17,19)
InChIKeyYBNSRYNVOWYPEW-UHFFFAOYSA-N
XLogP2.90
TPSA61.96 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.72
LogP ≤ 52.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-chloro-5-fluorophenyl)-6-methyl-4-oxo-1H-pyridine-3-carboxamide
CID 103717937
N-(2-chloro-4-methylphenyl)-2,4-dimethylbenzamide
CID 2557643
N-(2-chloro-4-methylphenyl)-2,5-dimethylbenzamide
CID 2549224
N-(2-chloro-4-methylphenyl)-2-iodobenzamide
CID 8886012
N-(5-bromo-2-chloro-3-pyridinyl)-6-methyl-4-oxo-1H-pyridine-3-carboxamide
CID 114052084
N-(2-chloro-4-methylphenyl)-2-methylbenzamide
CID 2540447
N-[5-chloro-2-(propylamino)phenyl]-6-methyl-4-oxo-1H-pyridine-3-carboxamide
CID 75499293
N-(2-fluorophenyl)-6-methyl-4-oxo-1H-pyridine-3-carboxamide
CID 110858598
N-(4-methoxy-2-methylphenyl)-6-methyl-4-oxo-1H-pyridine-3-carboxamide
CID 103717918
4-amino-2-chloro-N-(2-chloro-4-methylphenyl)benzamide
CID 28967456
2,3-dichloro-N-(2-chloro-4-methylphenyl)benzamide
CID 7926718
4-bromo-2-chloro-N-(2-chloro-4-methylphenyl)benzamide
CID 47299820

Frequently Asked Questions

What is the IUPAC name of N-(2-chloro-4-methylphenyl)-6-methyl-4-oxo-1H-pyridine-3-carboxamide?
The IUPAC name of N-(2-chloro-4-methylphenyl)-6-methyl-4-oxo-1H-pyridine-3-carboxamide (CID 103696175) is N-(2-chloro-4-methylphenyl)-6-methyl-4-oxo-1H-pyridine-3-carboxamide.
What is the SMILES notation for N-(2-chloro-4-methylphenyl)-6-methyl-4-oxo-1H-pyridine-3-carboxamide?
The canonical SMILES for N-(2-chloro-4-methylphenyl)-6-methyl-4-oxo-1H-pyridine-3-carboxamide is Cc1ccc(NC(=O)c2c[nH]c(C)cc2=O)c(Cl)c1.
What is the InChIKey of N-(2-chloro-4-methylphenyl)-6-methyl-4-oxo-1H-pyridine-3-carboxamide?
The InChIKey is YBNSRYNVOWYPEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13ClN2O2/c1-8-3-4-12(11(15)5-8)17-14(19)10-7-16-9(2)6-13(10)18/h3-7H,1-2H3,(H,16,18)(H,17,19).
What are the key properties of N-(2-chloro-4-methylphenyl)-6-methyl-4-oxo-1H-pyridine-3-carboxamide?
N-(2-chloro-4-methylphenyl)-6-methyl-4-oxo-1H-pyridine-3-carboxamide has a molecular weight of 276.72 g/mol, XLogP of 2.90, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chloro-4-methylphenyl)-6-methyl-4-oxo-1H-pyridine-3-carboxamide is sourced from PubChem (CID 103696175), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).