1-(4-fluoro-2-iodophenyl)-4-hydroxy-6-oxopyridine-2-carboxylic acid

C12H7FINO4 — CID 114207533

IUPAC1-(4-fluoro-2-iodophenyl)-4-hydroxy-6-oxopyridine-2-carboxylic acid
SMILESO=C(O)c1cc(O)cc(=O)n1-c1ccc(F)cc1I
InChIInChI=1S/C12H7FINO4/c13-6-1-2-9(8(14)3-6)15-10(12(18)19)4-7(16)5-11(15)17/h1-5,16H,(H,18,19)
InChIKeyXHDLBPRKQRWJED-UHFFFAOYSA-N
MW375.09 g/mol
LogP1.99
Rot. Bonds2

About 1-(4-fluoro-2-iodophenyl)-4-hydroxy-6-oxopyridine-2-carboxylic acid

1-(4-fluoro-2-iodophenyl)-4-hydroxy-6-oxopyridine-2-carboxylic acid (PubChem CID 114207533) has the molecular formula C12H7FINO4 and a molecular weight of 375.09 g/mol. Its IUPAC name is 1-(4-fluoro-2-iodophenyl)-4-hydroxy-6-oxopyridine-2-carboxylic acid.

Molecular Properties

Compound Name1-(4-fluoro-2-iodophenyl)-4-hydroxy-6-oxopyridine-2-carboxylic acid
PubChem CID114207533
Molecular FormulaC12H7FINO4
Molecular Weight375.09 g/mol
Exact Mass374.94
IUPAC Name1-(4-fluoro-2-iodophenyl)-4-hydroxy-6-oxopyridine-2-carboxylic acid
SMILESO=C(O)c1cc(O)cc(=O)n1-c1ccc(F)cc1I
InChIInChI=1S/C12H7FINO4/c13-6-1-2-9(8(14)3-6)15-10(12(18)19)4-7(16)5-11(15)17/h1-5,16H,(H,18,19)
InChIKeyXHDLBPRKQRWJED-UHFFFAOYSA-N
XLogP1.99
TPSA79.53 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.09
LogP ≤ 51.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'iodine', 'substructure': 'N/A'}

Analyze 1-(4-fluoro-2-iodophenyl)-4-hydroxy-6-oxopyridine-2-carboxylic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(2-bromo-5-iodophenyl)-4-hydroxy-6-oxopyridine-2-carboxylic acid
CID 114261168
1-(4-fluoro-2-iodophenyl)-3,4-dimethylpyrrole-2,5-dione
CID 79766324
1-(2-chloro-4-fluorophenyl)-4-iodopyrrole-2-carboxylic acid
CID 114603399
2-[[4-(4-fluoro-2-iodophenyl)-5-oxo-1H-1,2,4-triazol-3-yl]sulfanyl]acetic acid
CID 79772080
4-hydroxy-1-(6-methyl-3-pyridinyl)-6-oxopyridine-2-carboxylic acid
CID 114207546
1-(4-fluoro-2-iodophenyl)-5-methyl-4-oxopyridazine-3-carboxylic acid
CID 79771802
1-(4-fluoro-2-iodophenyl)pyrrolidine-2,3-dione
CID 79766126
1-(5-fluoro-2-methylphenyl)-4-iodopyrrole-2-carboxylic acid
CID 114603585
2-[[5-ethyl-4-(4-fluoro-2-iodophenyl)-1,2,4-triazol-3-yl]sulfanyl]acetic acid
CID 79766989
1-(4-fluoro-2-iodophenyl)-2,5-dimethylpyrrole-3-carbaldehyde
CID 79765998
4-bromo-1-(2-bromo-4-fluorophenyl)pyrrole-2-carboxylic acid
CID 114603698
1-(4-fluoro-2-iodophenyl)azepan-2-one
CID 79765997

Frequently Asked Questions

What is the IUPAC name of 1-(4-fluoro-2-iodophenyl)-4-hydroxy-6-oxopyridine-2-carboxylic acid?
The IUPAC name of 1-(4-fluoro-2-iodophenyl)-4-hydroxy-6-oxopyridine-2-carboxylic acid (CID 114207533) is 1-(4-fluoro-2-iodophenyl)-4-hydroxy-6-oxopyridine-2-carboxylic acid.
What is the SMILES notation for 1-(4-fluoro-2-iodophenyl)-4-hydroxy-6-oxopyridine-2-carboxylic acid?
The canonical SMILES for 1-(4-fluoro-2-iodophenyl)-4-hydroxy-6-oxopyridine-2-carboxylic acid is O=C(O)c1cc(O)cc(=O)n1-c1ccc(F)cc1I.
What is the InChIKey of 1-(4-fluoro-2-iodophenyl)-4-hydroxy-6-oxopyridine-2-carboxylic acid?
The InChIKey is XHDLBPRKQRWJED-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H7FINO4/c13-6-1-2-9(8(14)3-6)15-10(12(18)19)4-7(16)5-11(15)17/h1-5,16H,(H,18,19).
What are the key properties of 1-(4-fluoro-2-iodophenyl)-4-hydroxy-6-oxopyridine-2-carboxylic acid?
1-(4-fluoro-2-iodophenyl)-4-hydroxy-6-oxopyridine-2-carboxylic acid has a molecular weight of 375.09 g/mol, XLogP of 1.99, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-fluoro-2-iodophenyl)-4-hydroxy-6-oxopyridine-2-carboxylic acid is sourced from PubChem (CID 114207533), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).