2-chloro-5-(4-fluoro-2-hydroxyphenyl)pyridine-4-carboxylic acid

C12H7ClFNO3 — CID 53222942

IUPAC2-chloro-5-(4-fluoro-2-hydroxyphenyl)pyridine-4-carboxylic acid
SMILESO=C(O)c1cc(Cl)ncc1-c1ccc(F)cc1O
InChIInChI=1S/C12H7ClFNO3/c13-11-4-8(12(17)18)9(5-15-11)7-2-1-6(14)3-10(7)16/h1-5,16H,(H,17,18)
InChIKeyFXMANOILEIBZEM-UHFFFAOYSA-N
MW267.64 g/mol
LogP2.94
Rot. Bonds2

About 2-chloro-5-(4-fluoro-2-hydroxyphenyl)pyridine-4-carboxylic acid

2-chloro-5-(4-fluoro-2-hydroxyphenyl)pyridine-4-carboxylic acid (PubChem CID 53222942) has the molecular formula C12H7ClFNO3 and a molecular weight of 267.64 g/mol. Its IUPAC name is 2-chloro-5-(4-fluoro-2-hydroxyphenyl)pyridine-4-carboxylic acid.

Molecular Properties

Compound Name2-chloro-5-(4-fluoro-2-hydroxyphenyl)pyridine-4-carboxylic acid
PubChem CID53222942
Molecular FormulaC12H7ClFNO3
Molecular Weight267.64 g/mol
Exact Mass267.01
IUPAC Name2-chloro-5-(4-fluoro-2-hydroxyphenyl)pyridine-4-carboxylic acid
SMILESO=C(O)c1cc(Cl)ncc1-c1ccc(F)cc1O
InChIInChI=1S/C12H7ClFNO3/c13-11-4-8(12(17)18)9(5-15-11)7-2-1-6(14)3-10(7)16/h1-5,16H,(H,17,18)
InChIKeyFXMANOILEIBZEM-UHFFFAOYSA-N
XLogP2.94
TPSA70.42 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.64
LogP ≤ 52.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

Analyze 2-chloro-5-(4-fluoro-2-hydroxyphenyl)pyridine-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

Related Compounds

5-fluoro-2-(4-fluoro-2-hydroxyphenyl)benzoic acid
CID 53225681
2-chloro-5-(2,3,4-trichlorophenyl)pyridine-4-carboxylic acid
CID 119011318
2-chloro-5-(2,3-difluorophenyl)pyridine-4-carboxylic acid
CID 53223063
5-(4-carboxy-3-fluorophenyl)-2-chloropyridine-4-carboxylic acid
CID 53223834
6-chloro-4-(4-fluorophenyl)pyridine-3-carboxylic acid
CID 23502836
2-chloro-5-(4-methylphenyl)pyridine-4-carboxylic acid
CID 53222532
2-chloro-5-(2,5-dimethylphenyl)pyridine-4-carboxylic acid
CID 53222689
2-chloro-5-[4-(trifluoromethyl)phenyl]pyridine-4-carboxylic acid
CID 53223969
2-chloro-5-(2,4-dimethoxyphenyl)pyridine-4-carboxylic acid
CID 53223746
5-(4-carboxy-6-chloro-3-pyridinyl)benzene-1,3-dicarboxylic acid
CID 53224362
2-chloro-5-(3-chlorophenyl)pyridine-4-carboxylic acid
CID 53223009
2-chloro-5-[4-fluoro-3-(trifluoromethyl)phenyl]pyridine-4-carboxylic acid
CID 53224345

Frequently Asked Questions

What is the IUPAC name of 2-chloro-5-(4-fluoro-2-hydroxyphenyl)pyridine-4-carboxylic acid?
The IUPAC name of 2-chloro-5-(4-fluoro-2-hydroxyphenyl)pyridine-4-carboxylic acid (CID 53222942) is 2-chloro-5-(4-fluoro-2-hydroxyphenyl)pyridine-4-carboxylic acid.
What is the SMILES notation for 2-chloro-5-(4-fluoro-2-hydroxyphenyl)pyridine-4-carboxylic acid?
The canonical SMILES for 2-chloro-5-(4-fluoro-2-hydroxyphenyl)pyridine-4-carboxylic acid is O=C(O)c1cc(Cl)ncc1-c1ccc(F)cc1O.
What is the InChIKey of 2-chloro-5-(4-fluoro-2-hydroxyphenyl)pyridine-4-carboxylic acid?
The InChIKey is FXMANOILEIBZEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H7ClFNO3/c13-11-4-8(12(17)18)9(5-15-11)7-2-1-6(14)3-10(7)16/h1-5,16H,(H,17,18).
What are the key properties of 2-chloro-5-(4-fluoro-2-hydroxyphenyl)pyridine-4-carboxylic acid?
2-chloro-5-(4-fluoro-2-hydroxyphenyl)pyridine-4-carboxylic acid has a molecular weight of 267.64 g/mol, XLogP of 2.94, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-5-(4-fluoro-2-hydroxyphenyl)pyridine-4-carboxylic acid is sourced from PubChem (CID 53222942), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).