2-(2,4-difluorophenyl)-5-hydroxypyridine-4-carboxylic acid

C12H7F2NO3 — CID 116864751

IUPAC2-(2,4-difluorophenyl)-5-hydroxypyridine-4-carboxylic acid
SMILESO=C(O)c1cc(-c2ccc(F)cc2F)ncc1O
InChIInChI=1S/C12H7F2NO3/c13-6-1-2-7(9(14)3-6)10-4-8(12(17)18)11(16)5-15-10/h1-5,16H,(H,17,18)
InChIKeyMSDMBPLIFTWKLG-UHFFFAOYSA-N
MW251.19 g/mol
LogP2.43
Rot. Bonds2

About 2-(2,4-difluorophenyl)-5-hydroxypyridine-4-carboxylic acid

2-(2,4-difluorophenyl)-5-hydroxypyridine-4-carboxylic acid (PubChem CID 116864751) has the molecular formula C12H7F2NO3 and a molecular weight of 251.19 g/mol. Its IUPAC name is 2-(2,4-difluorophenyl)-5-hydroxypyridine-4-carboxylic acid.

Molecular Properties

Compound Name2-(2,4-difluorophenyl)-5-hydroxypyridine-4-carboxylic acid
PubChem CID116864751
Molecular FormulaC12H7F2NO3
Molecular Weight251.19 g/mol
Exact Mass251.04
IUPAC Name2-(2,4-difluorophenyl)-5-hydroxypyridine-4-carboxylic acid
SMILESO=C(O)c1cc(-c2ccc(F)cc2F)ncc1O
InChIInChI=1S/C12H7F2NO3/c13-6-1-2-7(9(14)3-6)10-4-8(12(17)18)11(16)5-15-10/h1-5,16H,(H,17,18)
InChIKeyMSDMBPLIFTWKLG-UHFFFAOYSA-N
XLogP2.43
TPSA70.42 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.19
LogP ≤ 52.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-(2,4-difluorophenyl)-5-hydroxypyridine-4-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

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-difluorophenyl)-5-hydroxypyridine-4-carboxylic acid?
The IUPAC name of 2-(2,4-difluorophenyl)-5-hydroxypyridine-4-carboxylic acid (CID 116864751) is 2-(2,4-difluorophenyl)-5-hydroxypyridine-4-carboxylic acid.
What is the SMILES notation for 2-(2,4-difluorophenyl)-5-hydroxypyridine-4-carboxylic acid?
The canonical SMILES for 2-(2,4-difluorophenyl)-5-hydroxypyridine-4-carboxylic acid is O=C(O)c1cc(-c2ccc(F)cc2F)ncc1O.
What is the InChIKey of 2-(2,4-difluorophenyl)-5-hydroxypyridine-4-carboxylic acid?
The InChIKey is MSDMBPLIFTWKLG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H7F2NO3/c13-6-1-2-7(9(14)3-6)10-4-8(12(17)18)11(16)5-15-10/h1-5,16H,(H,17,18).
What are the key properties of 2-(2,4-difluorophenyl)-5-hydroxypyridine-4-carboxylic acid?
2-(2,4-difluorophenyl)-5-hydroxypyridine-4-carboxylic acid has a molecular weight of 251.19 g/mol, XLogP of 2.43, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-difluorophenyl)-5-hydroxypyridine-4-carboxylic acid is sourced from PubChem (CID 116864751), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).