1-(4-hydroxyphenyl)-6-methyl-4-oxopyridine-3-carboxylic acid

C13H11NO4 — CID 14027756

IUPAC1-(4-hydroxyphenyl)-6-methyl-4-oxopyridine-3-carboxylic acid
SMILESCc1cc(=O)c(C(=O)O)cn1-c1ccc(O)cc1
InChIInChI=1S/C13H11NO4/c1-8-6-12(16)11(13(17)18)7-14(8)9-2-4-10(15)5-3-9/h2-7,15H,1H3,(H,17,18)
InChIKeyGPOXCQTVECLSTJ-UHFFFAOYSA-N
MW245.23 g/mol
LogP1.55
Rot. Bonds2

About 1-(4-hydroxyphenyl)-6-methyl-4-oxopyridine-3-carboxylic acid

1-(4-hydroxyphenyl)-6-methyl-4-oxopyridine-3-carboxylic acid (PubChem CID 14027756) has the molecular formula C13H11NO4 and a molecular weight of 245.23 g/mol. Its IUPAC name is 1-(4-hydroxyphenyl)-6-methyl-4-oxopyridine-3-carboxylic acid.

Molecular Properties

Compound Name1-(4-hydroxyphenyl)-6-methyl-4-oxopyridine-3-carboxylic acid
PubChem CID14027756
Molecular FormulaC13H11NO4
Molecular Weight245.23 g/mol
Exact Mass245.07
IUPAC Name1-(4-hydroxyphenyl)-6-methyl-4-oxopyridine-3-carboxylic acid
SMILESCc1cc(=O)c(C(=O)O)cn1-c1ccc(O)cc1
InChIInChI=1S/C13H11NO4/c1-8-6-12(16)11(13(17)18)7-14(8)9-2-4-10(15)5-3-9/h2-7,15H,1H3,(H,17,18)
InChIKeyGPOXCQTVECLSTJ-UHFFFAOYSA-N
XLogP1.55
TPSA79.53 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.23
LogP ≤ 51.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

6-methyl-1-(3-methylphenyl)-4-oxopyridine-3-carboxylic acid
CID 1489807
4-(5-hydroxy-2-methyl-4-oxo-1-pyridinyl)benzoic acid
CID 130424057
6-methyl-1-(2-methylphenyl)-4-oxopyridine-3-carboxylic acid
CID 82419564
1-(2,4-difluorophenyl)-6-methyl-4-oxopyridine-3-carboxylic acid
CID 82421494
1-(2,5-dimethylphenyl)-6-methyl-4-oxopyridine-3-carboxylic acid
CID 82420382
5-acetyl-1-(4-methoxyphenyl)-2-methylpyridin-4-one
CID 82421340
6-methyl-4-oxo-1-(4-propan-2-ylphenyl)pyridine-3-carboxylate
CID 35549170
5-acetyl-1-(4-ethoxyphenyl)-2-methylpyridin-4-one
CID 82420020
1-(4-chlorophenyl)-6-methyl-4-oxopyridine-3-carbothioamide
CID 82422137
6-formyl-1-(4-hydroxy-2-methylphenyl)-4-oxopyridine-3-carboxylic acid
CID 14010769
2-(6-methyl-4-oxo-1-phenyl-3-pyridinyl)acetic acid
CID 82419755
1-(3,4-dimethoxyphenyl)-6-methyl-4-oxopyridine-3-carbonyl chloride
CID 82419028

Frequently Asked Questions

What is the IUPAC name of 1-(4-hydroxyphenyl)-6-methyl-4-oxopyridine-3-carboxylic acid?
The IUPAC name of 1-(4-hydroxyphenyl)-6-methyl-4-oxopyridine-3-carboxylic acid (CID 14027756) is 1-(4-hydroxyphenyl)-6-methyl-4-oxopyridine-3-carboxylic acid.
What is the SMILES notation for 1-(4-hydroxyphenyl)-6-methyl-4-oxopyridine-3-carboxylic acid?
The canonical SMILES for 1-(4-hydroxyphenyl)-6-methyl-4-oxopyridine-3-carboxylic acid is Cc1cc(=O)c(C(=O)O)cn1-c1ccc(O)cc1.
What is the InChIKey of 1-(4-hydroxyphenyl)-6-methyl-4-oxopyridine-3-carboxylic acid?
The InChIKey is GPOXCQTVECLSTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11NO4/c1-8-6-12(16)11(13(17)18)7-14(8)9-2-4-10(15)5-3-9/h2-7,15H,1H3,(H,17,18).
What are the key properties of 1-(4-hydroxyphenyl)-6-methyl-4-oxopyridine-3-carboxylic acid?
1-(4-hydroxyphenyl)-6-methyl-4-oxopyridine-3-carboxylic acid has a molecular weight of 245.23 g/mol, XLogP of 1.55, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-hydroxyphenyl)-6-methyl-4-oxopyridine-3-carboxylic acid is sourced from PubChem (CID 14027756), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).