3-fluoro-6-(4-fluorophenyl)pyridine-2-carboxylic acid

C12H7F2NO2 — CID 46313905

IUPAC3-fluoro-6-(4-fluorophenyl)pyridine-2-carboxylic acid
SMILESO=C(O)c1nc(-c2ccc(F)cc2)ccc1F
InChIInChI=1S/C12H7F2NO2/c13-8-3-1-7(2-4-8)10-6-5-9(14)11(15-10)12(16)17/h1-6H,(H,16,17)
InChIKeyDCGAIAQNYIDZFY-UHFFFAOYSA-N
MW235.19 g/mol
LogP2.72
Rot. Bonds2

About 3-fluoro-6-(4-fluorophenyl)pyridine-2-carboxylic acid

3-fluoro-6-(4-fluorophenyl)pyridine-2-carboxylic acid (PubChem CID 46313905) has the molecular formula C12H7F2NO2 and a molecular weight of 235.19 g/mol. Its IUPAC name is 3-fluoro-6-(4-fluorophenyl)pyridine-2-carboxylic acid.

Molecular Properties

Compound Name3-fluoro-6-(4-fluorophenyl)pyridine-2-carboxylic acid
PubChem CID46313905
Molecular FormulaC12H7F2NO2
Molecular Weight235.19 g/mol
Exact Mass235.04
IUPAC Name3-fluoro-6-(4-fluorophenyl)pyridine-2-carboxylic acid
SMILESO=C(O)c1nc(-c2ccc(F)cc2)ccc1F
InChIInChI=1S/C12H7F2NO2/c13-8-3-1-7(2-4-8)10-6-5-9(14)11(15-10)12(16)17/h1-6H,(H,16,17)
InChIKeyDCGAIAQNYIDZFY-UHFFFAOYSA-N
XLogP2.72
TPSA50.19 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.19
LogP ≤ 52.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-chloro-6-(4-fluorophenyl)pyridine-3-carboxylic acid
CID 46313848
3-fluoro-6-(2,4,6-trichlorophenyl)pyridine-2-carboxylic acid
CID 133090327
2-[3,6-bis(4-fluorophenyl)-2-pyridinyl]acetic acid
CID 131869699
3-fluoro-6-(4-fluorophenyl)-2-methylpyridine
CID 46312609
2-amino-6-(4-fluorophenyl)pyrimidine-4-carboxylic acid
CID 28799560
6-fluoro-3-(4-fluorophenyl)pyridine-2-carboxylic acid
CID 46313893
6-(4-fluorophenyl)pyridine-3-carboxylic acid
CID 22730186
6-chloro-2-(4-fluorophenyl)quinoline-4-carboxylic acid
CID 3899945
2-(4-fluorophenyl)pyrrolo[1,2-a]pyrimidine-8-carboxylic acid
CID 131988328
3,6-bis(3-fluorophenyl)pyridine-2-carboxylic acid
CID 46313709
2-[6-(4-fluorophenyl)-2-pyridinyl]benzoic acid
CID 90041623
3-methyl-6-phenylpyridine-2-carboxylic acid
CID 71435914

Frequently Asked Questions

What is the IUPAC name of 3-fluoro-6-(4-fluorophenyl)pyridine-2-carboxylic acid?
The IUPAC name of 3-fluoro-6-(4-fluorophenyl)pyridine-2-carboxylic acid (CID 46313905) is 3-fluoro-6-(4-fluorophenyl)pyridine-2-carboxylic acid.
What is the SMILES notation for 3-fluoro-6-(4-fluorophenyl)pyridine-2-carboxylic acid?
The canonical SMILES for 3-fluoro-6-(4-fluorophenyl)pyridine-2-carboxylic acid is O=C(O)c1nc(-c2ccc(F)cc2)ccc1F.
What is the InChIKey of 3-fluoro-6-(4-fluorophenyl)pyridine-2-carboxylic acid?
The InChIKey is DCGAIAQNYIDZFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H7F2NO2/c13-8-3-1-7(2-4-8)10-6-5-9(14)11(15-10)12(16)17/h1-6H,(H,16,17).
What are the key properties of 3-fluoro-6-(4-fluorophenyl)pyridine-2-carboxylic acid?
3-fluoro-6-(4-fluorophenyl)pyridine-2-carboxylic acid has a molecular weight of 235.19 g/mol, XLogP of 2.72, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-6-(4-fluorophenyl)pyridine-2-carboxylic acid is sourced from PubChem (CID 46313905), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).