3-hydroxy-2-methyl-5-phenylpyridine-4-carboxylic acid

C13H11NO3 — CID 82391092

IUPAC3-hydroxy-2-methyl-5-phenylpyridine-4-carboxylic acid
SMILESCc1ncc(-c2ccccc2)c(C(=O)O)c1O
InChIInChI=1S/C13H11NO3/c1-8-12(15)11(13(16)17)10(7-14-8)9-5-3-2-4-6-9/h2-7,15H,1H3,(H,16,17)
InChIKeyCSVBGKOXGLYOTA-UHFFFAOYSA-N
MW229.24 g/mol
LogP2.46
Rot. Bonds2

About 3-hydroxy-2-methyl-5-phenylpyridine-4-carboxylic acid

3-hydroxy-2-methyl-5-phenylpyridine-4-carboxylic acid (PubChem CID 82391092) has the molecular formula C13H11NO3 and a molecular weight of 229.24 g/mol. Its IUPAC name is 3-hydroxy-2-methyl-5-phenylpyridine-4-carboxylic acid.

Molecular Properties

Compound Name3-hydroxy-2-methyl-5-phenylpyridine-4-carboxylic acid
PubChem CID82391092
Molecular FormulaC13H11NO3
Molecular Weight229.24 g/mol
Exact Mass229.07
IUPAC Name3-hydroxy-2-methyl-5-phenylpyridine-4-carboxylic acid
SMILESCc1ncc(-c2ccccc2)c(C(=O)O)c1O
InChIInChI=1S/C13H11NO3/c1-8-12(15)11(13(16)17)10(7-14-8)9-5-3-2-4-6-9/h2-7,15H,1H3,(H,16,17)
InChIKeyCSVBGKOXGLYOTA-UHFFFAOYSA-N
XLogP2.46
TPSA70.42 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.24
LogP ≤ 52.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3-hydroxy-2-methyl-5-pyridin-2-ylpyridine-4-carboxylic acid
CID 96600804
5-hydroxy-6-methylpyridine-3,4-dicarboxylic acid;hydrochloride
CID 159409477
4,5-diphenylpyridine-2,3-dicarboxylic acid
CID 151906058
1-methyl-4-phenylisoquinoline;dihydrochloride
CID 70514561
6,7-dimethoxy-3-phenylquinoline-4-carboxylic acid
CID 18788641
5-phenylpyridazine-3,4-dicarboxylic acid
CID 121011282
3,6-dihydroxy-4-phenylphthalic acid
CID 175175774
6-methyl-4-phenylpyridine-3-carboxylic acid
CID 82113463
6-oxo-4-phenyl-1H-pyridazine-5-carboxylic acid
CID 39202461
5-ethoxycarbonyl-3-hydroxy-2-phenylpyridine-4-carboxylic acid;hydrochloride
CID 131710706
1-[3-hydroxy-5-(hydroxymethyl)-2-methyl-4-pyridinyl]ethanone
CID 90678912
3-hydroxy-4-methyl-5-(2-phenyl-1,3-thiazol-5-yl)pyridine-2-carboxylic acid
CID 162731592

Frequently Asked Questions

What is the IUPAC name of 3-hydroxy-2-methyl-5-phenylpyridine-4-carboxylic acid?
The IUPAC name of 3-hydroxy-2-methyl-5-phenylpyridine-4-carboxylic acid (CID 82391092) is 3-hydroxy-2-methyl-5-phenylpyridine-4-carboxylic acid.
What is the SMILES notation for 3-hydroxy-2-methyl-5-phenylpyridine-4-carboxylic acid?
The canonical SMILES for 3-hydroxy-2-methyl-5-phenylpyridine-4-carboxylic acid is Cc1ncc(-c2ccccc2)c(C(=O)O)c1O.
What is the InChIKey of 3-hydroxy-2-methyl-5-phenylpyridine-4-carboxylic acid?
The InChIKey is CSVBGKOXGLYOTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H11NO3/c1-8-12(15)11(13(16)17)10(7-14-8)9-5-3-2-4-6-9/h2-7,15H,1H3,(H,16,17).
What are the key properties of 3-hydroxy-2-methyl-5-phenylpyridine-4-carboxylic acid?
3-hydroxy-2-methyl-5-phenylpyridine-4-carboxylic acid has a molecular weight of 229.24 g/mol, XLogP of 2.46, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-hydroxy-2-methyl-5-phenylpyridine-4-carboxylic acid is sourced from PubChem (CID 82391092), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).