4,6-dimethyl-1-(4-methylphenyl)-2-oxopyridine-3-carboxylic acid

C15H15NO3 — CID 611686

IUPAC4,6-dimethyl-1-(4-methylphenyl)-2-oxopyridine-3-carboxylic acid
SMILESCc1ccc(-n2c(C)cc(C)c(C(=O)O)c2=O)cc1
InChIInChI=1S/C15H15NO3/c1-9-4-6-12(7-5-9)16-11(3)8-10(2)13(14(16)17)15(18)19/h4-8H,1-3H3,(H,18,19)
InChIKeyUNMIBNILTJLXOH-UHFFFAOYSA-N
MW257.29 g/mol
LogP2.46
Rot. Bonds2

About 4,6-dimethyl-1-(4-methylphenyl)-2-oxopyridine-3-carboxylic acid

4,6-dimethyl-1-(4-methylphenyl)-2-oxopyridine-3-carboxylic acid (PubChem CID 611686) has the molecular formula C15H15NO3 and a molecular weight of 257.29 g/mol. Its IUPAC name is 4,6-dimethyl-1-(4-methylphenyl)-2-oxopyridine-3-carboxylic acid.

Molecular Properties

Compound Name4,6-dimethyl-1-(4-methylphenyl)-2-oxopyridine-3-carboxylic acid
PubChem CID611686
Molecular FormulaC15H15NO3
Molecular Weight257.29 g/mol
Exact Mass257.11
IUPAC Name4,6-dimethyl-1-(4-methylphenyl)-2-oxopyridine-3-carboxylic acid
SMILESCc1ccc(-n2c(C)cc(C)c(C(=O)O)c2=O)cc1
InChIInChI=1S/C15H15NO3/c1-9-4-6-12(7-5-9)16-11(3)8-10(2)13(14(16)17)15(18)19/h4-8H,1-3H3,(H,18,19)
InChIKeyUNMIBNILTJLXOH-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 4,6-dimethyl-1-(4-methylphenyl)-2-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

Frequently Asked Questions

What is the IUPAC name of 4,6-dimethyl-1-(4-methylphenyl)-2-oxopyridine-3-carboxylic acid?
The IUPAC name of 4,6-dimethyl-1-(4-methylphenyl)-2-oxopyridine-3-carboxylic acid (CID 611686) is 4,6-dimethyl-1-(4-methylphenyl)-2-oxopyridine-3-carboxylic acid.
What is the SMILES notation for 4,6-dimethyl-1-(4-methylphenyl)-2-oxopyridine-3-carboxylic acid?
The canonical SMILES for 4,6-dimethyl-1-(4-methylphenyl)-2-oxopyridine-3-carboxylic acid is Cc1ccc(-n2c(C)cc(C)c(C(=O)O)c2=O)cc1.
What is the InChIKey of 4,6-dimethyl-1-(4-methylphenyl)-2-oxopyridine-3-carboxylic acid?
The InChIKey is UNMIBNILTJLXOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15NO3/c1-9-4-6-12(7-5-9)16-11(3)8-10(2)13(14(16)17)15(18)19/h4-8H,1-3H3,(H,18,19).
What are the key properties of 4,6-dimethyl-1-(4-methylphenyl)-2-oxopyridine-3-carboxylic acid?
4,6-dimethyl-1-(4-methylphenyl)-2-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 4,6-dimethyl-1-(4-methylphenyl)-2-oxopyridine-3-carboxylic acid is sourced from PubChem (CID 611686), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).