3-hydroxy-2-methyl-5-pyridin-2-ylpyridine-4-carboxylic acid

C12H10N2O3 — CID 96600804

IUPAC3-hydroxy-2-methyl-5-pyridin-2-ylpyridine-4-carboxylic acid
SMILESCc1ncc(-c2ccccn2)c(C(=O)O)c1O
InChIInChI=1S/C12H10N2O3/c1-7-11(15)10(12(16)17)8(6-14-7)9-4-2-3-5-13-9/h2-6,15H,1H3,(H,16,17)
InChIKeyOPUODUNUVYLITR-UHFFFAOYSA-N
MW230.22 g/mol
LogP1.86
Rot. Bonds2

About 3-hydroxy-2-methyl-5-pyridin-2-ylpyridine-4-carboxylic acid

3-hydroxy-2-methyl-5-pyridin-2-ylpyridine-4-carboxylic acid (PubChem CID 96600804) has the molecular formula C12H10N2O3 and a molecular weight of 230.22 g/mol. Its IUPAC name is 3-hydroxy-2-methyl-5-pyridin-2-ylpyridine-4-carboxylic acid.

Molecular Properties

Compound Name3-hydroxy-2-methyl-5-pyridin-2-ylpyridine-4-carboxylic acid
PubChem CID96600804
Molecular FormulaC12H10N2O3
Molecular Weight230.22 g/mol
Exact Mass230.07
IUPAC Name3-hydroxy-2-methyl-5-pyridin-2-ylpyridine-4-carboxylic acid
SMILESCc1ncc(-c2ccccn2)c(C(=O)O)c1O
InChIInChI=1S/C12H10N2O3/c1-7-11(15)10(12(16)17)8(6-14-7)9-4-2-3-5-13-9/h2-6,15H,1H3,(H,16,17)
InChIKeyOPUODUNUVYLITR-UHFFFAOYSA-N
XLogP1.86
TPSA83.31 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.22
LogP ≤ 51.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-hydroxy-2-methyl-5-phenylpyridine-4-carboxylic acid
CID 82391092
2,3-dimethyl-4-pyridin-2-ylbenzoic acid
CID 175747160
3-chloro-5-pyridin-2-ylpyridazine-4-carboxylic acid
CID 117127494
4-methyl-6-pyridin-2-ylpyrimidine-5-carboxylic acid
CID 82471218
5-hydroxy-6-methylpyridine-3,4-dicarboxylic acid;hydrochloride
CID 159409477
2-amino-4-pyridin-2-ylthiophene-3-carboxylic acid
CID 118992178
2-(2-methylphenyl)pyridine
CID 144596153
ethane;6-methyl-3-pyridin-2-ylpyridine-2-carboxylic acid
CID 142536082
4-pyridin-2-yl-1,2-oxazole-5-carboxylic acid
CID 82372800
2-pyridin-2-ylpyrimidine-5-carboxylic acid
CID 24903633
2,6-bis(2-pyridin-2-ylphenyl)phenol
CID 175876654
2-phenylpyridine;propan-2-one
CID 174845023

Frequently Asked Questions

What is the IUPAC name of 3-hydroxy-2-methyl-5-pyridin-2-ylpyridine-4-carboxylic acid?
The IUPAC name of 3-hydroxy-2-methyl-5-pyridin-2-ylpyridine-4-carboxylic acid (CID 96600804) is 3-hydroxy-2-methyl-5-pyridin-2-ylpyridine-4-carboxylic acid.
What is the SMILES notation for 3-hydroxy-2-methyl-5-pyridin-2-ylpyridine-4-carboxylic acid?
The canonical SMILES for 3-hydroxy-2-methyl-5-pyridin-2-ylpyridine-4-carboxylic acid is Cc1ncc(-c2ccccn2)c(C(=O)O)c1O.
What is the InChIKey of 3-hydroxy-2-methyl-5-pyridin-2-ylpyridine-4-carboxylic acid?
The InChIKey is OPUODUNUVYLITR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10N2O3/c1-7-11(15)10(12(16)17)8(6-14-7)9-4-2-3-5-13-9/h2-6,15H,1H3,(H,16,17).
What are the key properties of 3-hydroxy-2-methyl-5-pyridin-2-ylpyridine-4-carboxylic acid?
3-hydroxy-2-methyl-5-pyridin-2-ylpyridine-4-carboxylic acid has a molecular weight of 230.22 g/mol, XLogP of 1.86, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-hydroxy-2-methyl-5-pyridin-2-ylpyridine-4-carboxylic acid is sourced from PubChem (CID 96600804), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).