6-(2,4-difluorophenyl)-2-methylpyridine-3-carboxylic acid

C13H9F2NO2 — CID 69042733

IUPAC6-(2,4-difluorophenyl)-2-methylpyridine-3-carboxylic acid
SMILESCc1nc(-c2ccc(F)cc2F)ccc1C(=O)O
InChIInChI=1S/C13H9F2NO2/c1-7-9(13(17)18)4-5-12(16-7)10-3-2-8(14)6-11(10)15/h2-6H,1H3,(H,17,18)
InChIKeyGPPHXMZNKZZETE-UHFFFAOYSA-N
MW249.22 g/mol
LogP3.03
Rot. Bonds2

About 6-(2,4-difluorophenyl)-2-methylpyridine-3-carboxylic acid

6-(2,4-difluorophenyl)-2-methylpyridine-3-carboxylic acid (PubChem CID 69042733) has the molecular formula C13H9F2NO2 and a molecular weight of 249.22 g/mol. Its IUPAC name is 6-(2,4-difluorophenyl)-2-methylpyridine-3-carboxylic acid.

Molecular Properties

Compound Name6-(2,4-difluorophenyl)-2-methylpyridine-3-carboxylic acid
PubChem CID69042733
Molecular FormulaC13H9F2NO2
Molecular Weight249.22 g/mol
Exact Mass249.06
IUPAC Name6-(2,4-difluorophenyl)-2-methylpyridine-3-carboxylic acid
SMILESCc1nc(-c2ccc(F)cc2F)ccc1C(=O)O
InChIInChI=1S/C13H9F2NO2/c1-7-9(13(17)18)4-5-12(16-7)10-3-2-8(14)6-11(10)15/h2-6H,1H3,(H,17,18)
InChIKeyGPPHXMZNKZZETE-UHFFFAOYSA-N
XLogP3.03
TPSA50.19 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.22
LogP ≤ 53.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 6-(2,4-difluorophenyl)-2-methylpyridine-3-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

3-cyano-6-(2,4-difluorophenyl)-2-methylpyridine-4-carboxylic acid
CID 134083419
2-(2,4-difluorophenyl)-6-methylquinoline-4-carboxylic acid
CID 5238835
6-(3,4-difluorophenyl)-2-methylpyridine-3-carboxylic acid
CID 69038091
2-(2,4-difluorophenyl)-5,8-dimethylquinoline-4-carboxylic acid
CID 3881331
2-(2,4-difluorophenyl)-4-fluoro-5-methylbenzoic acid
CID 172914103
5-chloro-2-(2,4-difluorophenyl)-8-methylquinoline-4-carboxylic acid
CID 4579091
ethyl 6-(2-chloro-4-fluorophenyl)-2-methylpyridine-3-carboxylate
CID 115917522
6-(2,5-difluorophenyl)-2-(methylamino)pyridine-3-carboxylic acid
CID 82122308
6-(2-bromophenyl)-2-methylpyridine-3-carboxylic acid
CID 112562051
2-methyl-6-[2-(trifluoromethyl)phenyl]pyridine-3-carboxylic acid
CID 112694386
4-(2,4-difluorophenyl)-1,3-oxazole-2-carboxylic acid
CID 134209886
2-[[6-(2,4-difluorophenyl)-3-pyridinyl]methyl]-5-methylbenzoic acid
CID 58415864

Frequently Asked Questions

What is the IUPAC name of 6-(2,4-difluorophenyl)-2-methylpyridine-3-carboxylic acid?
The IUPAC name of 6-(2,4-difluorophenyl)-2-methylpyridine-3-carboxylic acid (CID 69042733) is 6-(2,4-difluorophenyl)-2-methylpyridine-3-carboxylic acid.
What is the SMILES notation for 6-(2,4-difluorophenyl)-2-methylpyridine-3-carboxylic acid?
The canonical SMILES for 6-(2,4-difluorophenyl)-2-methylpyridine-3-carboxylic acid is Cc1nc(-c2ccc(F)cc2F)ccc1C(=O)O.
What is the InChIKey of 6-(2,4-difluorophenyl)-2-methylpyridine-3-carboxylic acid?
The InChIKey is GPPHXMZNKZZETE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H9F2NO2/c1-7-9(13(17)18)4-5-12(16-7)10-3-2-8(14)6-11(10)15/h2-6H,1H3,(H,17,18).
What are the key properties of 6-(2,4-difluorophenyl)-2-methylpyridine-3-carboxylic acid?
6-(2,4-difluorophenyl)-2-methylpyridine-3-carboxylic acid has a molecular weight of 249.22 g/mol, XLogP of 3.03, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2,4-difluorophenyl)-2-methylpyridine-3-carboxylic acid is sourced from PubChem (CID 69042733), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).