5-hydroxy-4-methylpyridine-3-carboxylic acid

C7H7NO3 — CID 105429833

IUPAC5-hydroxy-4-methylpyridine-3-carboxylic acid
SMILESCc1c(O)cncc1C(=O)O
InChIInChI=1S/C7H7NO3/c1-4-5(7(10)11)2-8-3-6(4)9/h2-3,9H,1H3,(H,10,11)
InChIKeyXXJQESGVXUPIAZ-UHFFFAOYSA-N
MW153.14 g/mol
LogP0.79
Rot. Bonds1

About 5-hydroxy-4-methylpyridine-3-carboxylic acid

5-hydroxy-4-methylpyridine-3-carboxylic acid (PubChem CID 105429833) has the molecular formula C7H7NO3 and a molecular weight of 153.14 g/mol. Its IUPAC name is 5-hydroxy-4-methylpyridine-3-carboxylic acid.

Molecular Properties

Compound Name5-hydroxy-4-methylpyridine-3-carboxylic acid
PubChem CID105429833
Molecular FormulaC7H7NO3
Molecular Weight153.14 g/mol
Exact Mass153.04
IUPAC Name5-hydroxy-4-methylpyridine-3-carboxylic acid
SMILESCc1c(O)cncc1C(=O)O
InChIInChI=1S/C7H7NO3/c1-4-5(7(10)11)2-8-3-6(4)9/h2-3,9H,1H3,(H,10,11)
InChIKeyXXJQESGVXUPIAZ-UHFFFAOYSA-N
XLogP0.79
TPSA70.42 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.14
LogP ≤ 50.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

methyl 5-hydroxy-4-methylpyridine-3-carboxylate
CID 130115769
4-methyl-5-pyridin-4-ylpyridine-3-carboxylic acid
CID 140683950
(E)-4-amino-4-(5-hydroxy-4-methyl-3-pyridinyl)but-3-en-2-one
CID 174275229
ethane;3-hydroxy-2,5-dimethylbenzoic acid
CID 142823767
3-acetylpyridine-4-carboxylic acid
CID 19902844
4-amino-5-iodopyridine-3-carboxylic acid
CID 71055662
pyridine-3,4-dicarboxylic acid;dihydrochloride
CID 70421739
2,3-dimethylterephthalic acid
CID 158313107
4-methyl-5-nitropyridin-3-ol
CID 131057783
3,4-dihydroxy-2-methylbenzoic acid
CID 10442073
2-methylfuro[3,2-c]pyridine-7-carboxylic acid
CID 178038733
4-[(3-hydroxypyridine-4-carbonyl)amino]-2-methylbenzoic acid
CID 81445783

Frequently Asked Questions

What is the IUPAC name of 5-hydroxy-4-methylpyridine-3-carboxylic acid?
The IUPAC name of 5-hydroxy-4-methylpyridine-3-carboxylic acid (CID 105429833) is 5-hydroxy-4-methylpyridine-3-carboxylic acid.
What is the SMILES notation for 5-hydroxy-4-methylpyridine-3-carboxylic acid?
The canonical SMILES for 5-hydroxy-4-methylpyridine-3-carboxylic acid is Cc1c(O)cncc1C(=O)O.
What is the InChIKey of 5-hydroxy-4-methylpyridine-3-carboxylic acid?
The InChIKey is XXJQESGVXUPIAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7NO3/c1-4-5(7(10)11)2-8-3-6(4)9/h2-3,9H,1H3,(H,10,11).
What are the key properties of 5-hydroxy-4-methylpyridine-3-carboxylic acid?
5-hydroxy-4-methylpyridine-3-carboxylic acid has a molecular weight of 153.14 g/mol, XLogP of 0.79, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-hydroxy-4-methylpyridine-3-carboxylic acid is sourced from PubChem (CID 105429833), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).