2-(2-hydroxy-6-oxo-1H-pyridin-3-yl)acetic acid

C7H7NO4 — CID 119085700

IUPAC2-(2-hydroxy-6-oxo-1H-pyridin-3-yl)acetic acid
SMILESO=C(O)Cc1ccc(=O)[nH]c1O
InChIInChI=1S/C7H7NO4/c9-5-2-1-4(3-6(10)11)7(12)8-5/h1-2H,3H2,(H,10,11)(H2,8,9,12)
InChIKeyWLZIEMGIXMZLOX-UHFFFAOYSA-N
MW169.14 g/mol
LogP-0.29
Rot. Bonds2

About 2-(2-hydroxy-6-oxo-1H-pyridin-3-yl)acetic acid

2-(2-hydroxy-6-oxo-1H-pyridin-3-yl)acetic acid (PubChem CID 119085700) has the molecular formula C7H7NO4 and a molecular weight of 169.14 g/mol. Its IUPAC name is 2-(2-hydroxy-6-oxo-1H-pyridin-3-yl)acetic acid.

Molecular Properties

Compound Name2-(2-hydroxy-6-oxo-1H-pyridin-3-yl)acetic acid
PubChem CID119085700
Molecular FormulaC7H7NO4
Molecular Weight169.14 g/mol
Exact Mass169.04
IUPAC Name2-(2-hydroxy-6-oxo-1H-pyridin-3-yl)acetic acid
SMILESO=C(O)Cc1ccc(=O)[nH]c1O
InChIInChI=1S/C7H7NO4/c9-5-2-1-4(3-6(10)11)7(12)8-5/h1-2H,3H2,(H,10,11)(H2,8,9,12)
InChIKeyWLZIEMGIXMZLOX-UHFFFAOYSA-N
XLogP-0.29
TPSA90.39 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.14
LogP ≤ 5-0.29
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

6-Hydroxy-4-methyl-2-oxo-1,2-dihydropyridine-3-carboxylic acid
CID 334847
2,6-Dihydroxynicotinic acid
CID 135526603
2,6-Dihydroxynicotinate
CID 135853911
2-hydroxy-4-methyl-6-oxo-1H-pyridine-3-carboxylate
CID 135674871
(2-Fluoro-6-hydroxypyridin-4-YL)acetic acid
CID 72212939
2-(2-fluoro-6-oxo-1H-pyridin-3-yl)acetic acid
CID 129915312
3-(difluoromethyl)-2-hydroxy-6-oxo-1H-pyridine-4-carboxylic acid
CID 130100260
2-[5-(difluoromethyl)-2-hydroxy-6-oxo-1H-pyridin-3-yl]acetic acid
CID 130100308
2-(2-hydroxy-4-methyl-6-oxo-1H-pyridin-3-yl)acetic acid
CID 23042611
2-hydroxy-3-methyl-6-oxo-1H-pyridine-4-carboxylic acid
CID 59676323
3-[3-(4-carboxy-2-hydroxy-6-oxo-1H-pyridin-3-yl)propa-1,2-dienyl]-2-hydroxy-6-oxo-1H-pyridine-4-carboxylic acid
CID 90821121
1-hydroxy-3-oxo-2H-isoquinoline-6-carboxylic acid
CID 91261818

Frequently Asked Questions

What is the IUPAC name of 2-(2-hydroxy-6-oxo-1H-pyridin-3-yl)acetic acid?
The IUPAC name of 2-(2-hydroxy-6-oxo-1H-pyridin-3-yl)acetic acid (CID 119085700) is 2-(2-hydroxy-6-oxo-1H-pyridin-3-yl)acetic acid.
What is the SMILES notation for 2-(2-hydroxy-6-oxo-1H-pyridin-3-yl)acetic acid?
The canonical SMILES for 2-(2-hydroxy-6-oxo-1H-pyridin-3-yl)acetic acid is O=C(O)Cc1ccc(=O)[nH]c1O.
What is the InChIKey of 2-(2-hydroxy-6-oxo-1H-pyridin-3-yl)acetic acid?
The InChIKey is WLZIEMGIXMZLOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7NO4/c9-5-2-1-4(3-6(10)11)7(12)8-5/h1-2H,3H2,(H,10,11)(H2,8,9,12).
What are the key properties of 2-(2-hydroxy-6-oxo-1H-pyridin-3-yl)acetic acid?
2-(2-hydroxy-6-oxo-1H-pyridin-3-yl)acetic acid has a molecular weight of 169.14 g/mol, XLogP of -0.29, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-hydroxy-6-oxo-1H-pyridin-3-yl)acetic acid is sourced from PubChem (CID 119085700), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).