6-(4-methoxyphenyl)-2-oxo-1H-pyridine-3-carboxylic acid

C13H11NO4 — CID 2768366

IUPAC6-(4-methoxyphenyl)-2-oxo-1H-pyridine-3-carboxylic acid
SMILESCOc1ccc(-c2ccc(C(=O)O)c(=O)[nH]2)cc1
InChIInChI=1S/C13H11NO4/c1-18-9-4-2-8(3-5-9)11-7-6-10(13(16)17)12(15)14-11/h2-7H,1H3,(H,14,15)(H,16,17)
InChIKeyFQXDUENLSLFAOZ-UHFFFAOYSA-N
MW245.23 g/mol
LogP1.75
Rot. Bonds3

About 6-(4-methoxyphenyl)-2-oxo-1H-pyridine-3-carboxylic acid

6-(4-methoxyphenyl)-2-oxo-1H-pyridine-3-carboxylic acid (PubChem CID 2768366) has the molecular formula C13H11NO4 and a molecular weight of 245.23 g/mol. Its IUPAC name is 6-(4-methoxyphenyl)-2-oxo-1H-pyridine-3-carboxylic acid.

Molecular Properties

Compound Name6-(4-methoxyphenyl)-2-oxo-1H-pyridine-3-carboxylic acid
PubChem CID2768366
Molecular FormulaC13H11NO4
Molecular Weight245.23 g/mol
Exact Mass245.07
IUPAC Name6-(4-methoxyphenyl)-2-oxo-1H-pyridine-3-carboxylic acid
SMILESCOc1ccc(-c2ccc(C(=O)O)c(=O)[nH]2)cc1
InChIInChI=1S/C13H11NO4/c1-18-9-4-2-8(3-5-9)11-7-6-10(13(16)17)12(15)14-11/h2-7H,1H3,(H,14,15)(H,16,17)
InChIKeyFQXDUENLSLFAOZ-UHFFFAOYSA-N
XLogP1.75
TPSA79.39 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.23
LogP ≤ 51.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 6-(4-methoxyphenyl)-2-oxo-1H-pyridine-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 6-(4-methoxyphenyl)-2-oxo-1H-pyridine-3-carboxylic acid?
The IUPAC name of 6-(4-methoxyphenyl)-2-oxo-1H-pyridine-3-carboxylic acid (CID 2768366) is 6-(4-methoxyphenyl)-2-oxo-1H-pyridine-3-carboxylic acid.
What is the SMILES notation for 6-(4-methoxyphenyl)-2-oxo-1H-pyridine-3-carboxylic acid?
The canonical SMILES for 6-(4-methoxyphenyl)-2-oxo-1H-pyridine-3-carboxylic acid is COc1ccc(-c2ccc(C(=O)O)c(=O)[nH]2)cc1.
What is the InChIKey of 6-(4-methoxyphenyl)-2-oxo-1H-pyridine-3-carboxylic acid?
The InChIKey is FQXDUENLSLFAOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11NO4/c1-18-9-4-2-8(3-5-9)11-7-6-10(13(16)17)12(15)14-11/h2-7H,1H3,(H,14,15)(H,16,17).
What are the key properties of 6-(4-methoxyphenyl)-2-oxo-1H-pyridine-3-carboxylic acid?
6-(4-methoxyphenyl)-2-oxo-1H-pyridine-3-carboxylic acid has a molecular weight of 245.23 g/mol, XLogP of 1.75, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-methoxyphenyl)-2-oxo-1H-pyridine-3-carboxylic acid is sourced from PubChem (CID 2768366), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).