3-[(4-hydroxy-2-methylbenzoyl)amino]pyridine-2-carboxylic acid

C14H12N2O4 — CID 107670919

IUPAC3-[(4-hydroxy-2-methylbenzoyl)amino]pyridine-2-carboxylic acid
SMILESCc1cc(O)ccc1C(=O)Nc1cccnc1C(=O)O
InChIInChI=1S/C14H12N2O4/c1-8-7-9(17)4-5-10(8)13(18)16-11-3-2-6-15-12(11)14(19)20/h2-7,17H,1H3,(H,16,18)(H,19,20)
InChIKeyXYNARLJVNSLYBK-UHFFFAOYSA-N
MW272.26 g/mol
LogP2.05
Rot. Bonds3

About 3-[(4-hydroxy-2-methylbenzoyl)amino]pyridine-2-carboxylic acid

3-[(4-hydroxy-2-methylbenzoyl)amino]pyridine-2-carboxylic acid (PubChem CID 107670919) has the molecular formula C14H12N2O4 and a molecular weight of 272.26 g/mol. Its IUPAC name is 3-[(4-hydroxy-2-methylbenzoyl)amino]pyridine-2-carboxylic acid.

Molecular Properties

Compound Name3-[(4-hydroxy-2-methylbenzoyl)amino]pyridine-2-carboxylic acid
PubChem CID107670919
Molecular FormulaC14H12N2O4
Molecular Weight272.26 g/mol
Exact Mass272.08
IUPAC Name3-[(4-hydroxy-2-methylbenzoyl)amino]pyridine-2-carboxylic acid
SMILESCc1cc(O)ccc1C(=O)Nc1cccnc1C(=O)O
InChIInChI=1S/C14H12N2O4/c1-8-7-9(17)4-5-10(8)13(18)16-11-3-2-6-15-12(11)14(19)20/h2-7,17H,1H3,(H,16,18)(H,19,20)
InChIKeyXYNARLJVNSLYBK-UHFFFAOYSA-N
XLogP2.05
TPSA99.52 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.26
LogP ≤ 52.05
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

4-hydroxy-2-methyl-N-pyrimidin-2-ylbenzamide
CID 103872165
3-[(2,6-dimethylpyridine-3-carbonyl)amino]pyridine-2-carboxylic acid
CID 104740370
3-[(2-methyl-5-methylsulfanylbenzoyl)amino]pyridine-2-carboxylic acid
CID 104740428
3-[(2-fluoro-5-methylbenzoyl)amino]pyridine-2-carboxylic acid
CID 104740167
3-[(2-bromo-5-methylbenzoyl)amino]pyridine-2-carboxylic acid
CID 104739652
4-hydroxy-3-[(4-hydroxy-2-methylbenzoyl)amino]benzoic acid
CID 107670939
3-[(2-methoxybenzoyl)amino]pyridine-2-carboxylic acid
CID 104740315
N-[2-(dimethylamino)phenyl]-4-hydroxy-2-methylbenzamide
CID 103863654
3-[(3-fluoro-5-methylbenzoyl)amino]pyridine-2-carboxylic acid
CID 104739659
5-[(4-hydroxy-2-methylbenzoyl)amino]pyridine-2-carboxylic acid
CID 107670888
3-[(5-methylpyrazine-2-carbonyl)amino]pyridine-2-carboxylic acid
CID 104740393
3-[(3-chloro-5-methylbenzoyl)amino]pyridine-2-carboxylic acid
CID 104740205

Frequently Asked Questions

What is the IUPAC name of 3-[(4-hydroxy-2-methylbenzoyl)amino]pyridine-2-carboxylic acid?
The IUPAC name of 3-[(4-hydroxy-2-methylbenzoyl)amino]pyridine-2-carboxylic acid (CID 107670919) is 3-[(4-hydroxy-2-methylbenzoyl)amino]pyridine-2-carboxylic acid.
What is the SMILES notation for 3-[(4-hydroxy-2-methylbenzoyl)amino]pyridine-2-carboxylic acid?
The canonical SMILES for 3-[(4-hydroxy-2-methylbenzoyl)amino]pyridine-2-carboxylic acid is Cc1cc(O)ccc1C(=O)Nc1cccnc1C(=O)O.
What is the InChIKey of 3-[(4-hydroxy-2-methylbenzoyl)amino]pyridine-2-carboxylic acid?
The InChIKey is XYNARLJVNSLYBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12N2O4/c1-8-7-9(17)4-5-10(8)13(18)16-11-3-2-6-15-12(11)14(19)20/h2-7,17H,1H3,(H,16,18)(H,19,20).
What are the key properties of 3-[(4-hydroxy-2-methylbenzoyl)amino]pyridine-2-carboxylic acid?
3-[(4-hydroxy-2-methylbenzoyl)amino]pyridine-2-carboxylic acid has a molecular weight of 272.26 g/mol, XLogP of 2.05, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(4-hydroxy-2-methylbenzoyl)amino]pyridine-2-carboxylic acid is sourced from PubChem (CID 107670919), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).