5-hydroxy-6-oxo-1H-pyridine-2-carboxylic acid

C6H5NO4 — CID 54729311

IUPAC5-hydroxy-6-oxo-1H-pyridine-2-carboxylic acid
SMILESO=C(O)c1ccc(O)c(=O)[nH]1
InChIInChI=1S/C6H5NO4/c8-4-2-1-3(6(10)11)7-5(4)9/h1-2,8H,(H,7,9)(H,10,11)
InChIKeyAMXUPGLXQKCPLP-UHFFFAOYSA-N
MW155.11 g/mol
LogP-0.22
Rot. Bonds1

About 5-hydroxy-6-oxo-1H-pyridine-2-carboxylic acid

5-hydroxy-6-oxo-1H-pyridine-2-carboxylic acid (PubChem CID 54729311) has the molecular formula C6H5NO4 and a molecular weight of 155.11 g/mol. Its IUPAC name is 5-hydroxy-6-oxo-1H-pyridine-2-carboxylic acid.

Molecular Properties

Compound Name5-hydroxy-6-oxo-1H-pyridine-2-carboxylic acid
PubChem CID54729311
Molecular FormulaC6H5NO4
Molecular Weight155.11 g/mol
Exact Mass155.02
IUPAC Name5-hydroxy-6-oxo-1H-pyridine-2-carboxylic acid
SMILESO=C(O)c1ccc(O)c(=O)[nH]1
InChIInChI=1S/C6H5NO4/c8-4-2-1-3(6(10)11)7-5(4)9/h1-2,8H,(H,7,9)(H,10,11)
InChIKeyAMXUPGLXQKCPLP-UHFFFAOYSA-N
XLogP-0.22
TPSA90.39 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.11
LogP ≤ 5-0.22
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-hydroxy-6-oxo-1H-pyridine-2-carboxylic acid?
The IUPAC name of 5-hydroxy-6-oxo-1H-pyridine-2-carboxylic acid (CID 54729311) is 5-hydroxy-6-oxo-1H-pyridine-2-carboxylic acid.
What is the SMILES notation for 5-hydroxy-6-oxo-1H-pyridine-2-carboxylic acid?
The canonical SMILES for 5-hydroxy-6-oxo-1H-pyridine-2-carboxylic acid is O=C(O)c1ccc(O)c(=O)[nH]1.
What is the InChIKey of 5-hydroxy-6-oxo-1H-pyridine-2-carboxylic acid?
The InChIKey is AMXUPGLXQKCPLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H5NO4/c8-4-2-1-3(6(10)11)7-5(4)9/h1-2,8H,(H,7,9)(H,10,11).
What are the key properties of 5-hydroxy-6-oxo-1H-pyridine-2-carboxylic acid?
5-hydroxy-6-oxo-1H-pyridine-2-carboxylic acid has a molecular weight of 155.11 g/mol, XLogP of -0.22, 1 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-hydroxy-6-oxo-1H-pyridine-2-carboxylic acid is sourced from PubChem (CID 54729311), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).