5-fluoro-4-hydroxy-2-oxo-1H-pyridine-3-carboxylic acid

C6H4FNO4 — CID 67784866

IUPAC5-fluoro-4-hydroxy-2-oxo-1H-pyridine-3-carboxylic acid
SMILESO=C(O)c1c(O)c(F)c[nH]c1=O
InChIInChI=1S/C6H4FNO4/c7-2-1-8-5(10)3(4(2)9)6(11)12/h1H,(H,11,12)(H2,8,9,10)
InChIKeyGSAAGVHCJUPWQK-UHFFFAOYSA-N
MW173.10 g/mol
LogP-0.08
Rot. Bonds1

About 5-fluoro-4-hydroxy-2-oxo-1H-pyridine-3-carboxylic acid

5-fluoro-4-hydroxy-2-oxo-1H-pyridine-3-carboxylic acid (PubChem CID 67784866) has the molecular formula C6H4FNO4 and a molecular weight of 173.10 g/mol. Its IUPAC name is 5-fluoro-4-hydroxy-2-oxo-1H-pyridine-3-carboxylic acid.

Molecular Properties

Compound Name5-fluoro-4-hydroxy-2-oxo-1H-pyridine-3-carboxylic acid
PubChem CID67784866
Molecular FormulaC6H4FNO4
Molecular Weight173.10 g/mol
Exact Mass173.01
IUPAC Name5-fluoro-4-hydroxy-2-oxo-1H-pyridine-3-carboxylic acid
SMILESO=C(O)c1c(O)c(F)c[nH]c1=O
InChIInChI=1S/C6H4FNO4/c7-2-1-8-5(10)3(4(2)9)6(11)12/h1H,(H,11,12)(H2,8,9,10)
InChIKeyGSAAGVHCJUPWQK-UHFFFAOYSA-N
XLogP-0.08
TPSA90.39 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.10
LogP ≤ 5-0.08
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-fluoro-4-hydroxy-2-oxo-1H-pyridine-3-carboxylic acid?
The IUPAC name of 5-fluoro-4-hydroxy-2-oxo-1H-pyridine-3-carboxylic acid (CID 67784866) is 5-fluoro-4-hydroxy-2-oxo-1H-pyridine-3-carboxylic acid.
What is the SMILES notation for 5-fluoro-4-hydroxy-2-oxo-1H-pyridine-3-carboxylic acid?
The canonical SMILES for 5-fluoro-4-hydroxy-2-oxo-1H-pyridine-3-carboxylic acid is O=C(O)c1c(O)c(F)c[nH]c1=O.
What is the InChIKey of 5-fluoro-4-hydroxy-2-oxo-1H-pyridine-3-carboxylic acid?
The InChIKey is GSAAGVHCJUPWQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H4FNO4/c7-2-1-8-5(10)3(4(2)9)6(11)12/h1H,(H,11,12)(H2,8,9,10).
What are the key properties of 5-fluoro-4-hydroxy-2-oxo-1H-pyridine-3-carboxylic acid?
5-fluoro-4-hydroxy-2-oxo-1H-pyridine-3-carboxylic acid has a molecular weight of 173.10 g/mol, XLogP of -0.08, 1 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-4-hydroxy-2-oxo-1H-pyridine-3-carboxylic acid is sourced from PubChem (CID 67784866), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).