1-(2,5-dimethylphenyl)-6-methyl-4-oxopyridine-3-carboxylic acid

C15H15NO3 — CID 82420382

IUPAC1-(2,5-dimethylphenyl)-6-methyl-4-oxopyridine-3-carboxylic acid
SMILESCc1ccc(C)c(-n2cc(C(=O)O)c(=O)cc2C)c1
InChIInChI=1S/C15H15NO3/c1-9-4-5-10(2)13(6-9)16-8-12(15(18)19)14(17)7-11(16)3/h4-8H,1-3H3,(H,18,19)
InChIKeySFCXVDZUFHIUOF-UHFFFAOYSA-N
MW257.29 g/mol
LogP2.46
Rot. Bonds2

About 1-(2,5-dimethylphenyl)-6-methyl-4-oxopyridine-3-carboxylic acid

1-(2,5-dimethylphenyl)-6-methyl-4-oxopyridine-3-carboxylic acid (PubChem CID 82420382) has the molecular formula C15H15NO3 and a molecular weight of 257.29 g/mol. Its IUPAC name is 1-(2,5-dimethylphenyl)-6-methyl-4-oxopyridine-3-carboxylic acid.

Molecular Properties

Compound Name1-(2,5-dimethylphenyl)-6-methyl-4-oxopyridine-3-carboxylic acid
PubChem CID82420382
Molecular FormulaC15H15NO3
Molecular Weight257.29 g/mol
Exact Mass257.11
IUPAC Name1-(2,5-dimethylphenyl)-6-methyl-4-oxopyridine-3-carboxylic acid
SMILESCc1ccc(C)c(-n2cc(C(=O)O)c(=O)cc2C)c1
InChIInChI=1S/C15H15NO3/c1-9-4-5-10(2)13(6-9)16-8-12(15(18)19)14(17)7-11(16)3/h4-8H,1-3H3,(H,18,19)
InChIKeySFCXVDZUFHIUOF-UHFFFAOYSA-N
XLogP2.46
TPSA59.30 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.29
LogP ≤ 52.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-(2,5-dimethylphenyl)-6-methyl-4-oxopyridine-3-carboxylic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

6-methyl-1-(2-methylphenyl)-4-oxopyridine-3-carboxylic acid
CID 82419564
6-methyl-1-(3-methylphenyl)-4-oxopyridine-3-carboxylic acid
CID 1489807
1-(2,4-difluorophenyl)-6-methyl-4-oxopyridine-3-carboxylic acid
CID 82421494
1-(4-hydroxyphenyl)-6-methyl-4-oxopyridine-3-carboxylic acid
CID 14027756
1-(2,5-dimethylphenyl)-6-methyl-4-oxopyridazine-3-carboxylic acid
CID 43154905
5-acetyl-1-(2,6-dimethylphenyl)-2-methylpyridin-4-one
CID 82420257
1-(2,5-dimethylphenyl)-2-(4-methylphenyl)imidazole-4-carboxylic acid
CID 94946695
3-tert-butyl-1-(2,5-dimethylphenyl)pyrazole-4-carboxylic acid
CID 43324448
5-acetyl-2-methyl-1-(2,3,4-trifluorophenyl)pyridin-4-one
CID 82420875
2-[1-(2,5-dimethylphenyl)-6-methyl-4-oxopyridazin-3-yl]acetic acid
CID 82420431
2-(2,6-dimethyl-4-oxo-1-pyridinyl)-5-methylbenzoic acid
CID 79884479
6-formyl-1-(4-hydroxy-2-methylphenyl)-4-oxopyridine-3-carboxylic acid
CID 14010769

Frequently Asked Questions

What is the IUPAC name of 1-(2,5-dimethylphenyl)-6-methyl-4-oxopyridine-3-carboxylic acid?
The IUPAC name of 1-(2,5-dimethylphenyl)-6-methyl-4-oxopyridine-3-carboxylic acid (CID 82420382) is 1-(2,5-dimethylphenyl)-6-methyl-4-oxopyridine-3-carboxylic acid.
What is the SMILES notation for 1-(2,5-dimethylphenyl)-6-methyl-4-oxopyridine-3-carboxylic acid?
The canonical SMILES for 1-(2,5-dimethylphenyl)-6-methyl-4-oxopyridine-3-carboxylic acid is Cc1ccc(C)c(-n2cc(C(=O)O)c(=O)cc2C)c1.
What is the InChIKey of 1-(2,5-dimethylphenyl)-6-methyl-4-oxopyridine-3-carboxylic acid?
The InChIKey is SFCXVDZUFHIUOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15NO3/c1-9-4-5-10(2)13(6-9)16-8-12(15(18)19)14(17)7-11(16)3/h4-8H,1-3H3,(H,18,19).
What are the key properties of 1-(2,5-dimethylphenyl)-6-methyl-4-oxopyridine-3-carboxylic acid?
1-(2,5-dimethylphenyl)-6-methyl-4-oxopyridine-3-carboxylic acid has a molecular weight of 257.29 g/mol, XLogP of 2.46, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,5-dimethylphenyl)-6-methyl-4-oxopyridine-3-carboxylic acid is sourced from PubChem (CID 82420382), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).