2-(2,3-difluorophenyl)-3-(trifluoromethyl)pyridine

C12H6F5N — CID 170837725

IUPAC2-(2,3-difluorophenyl)-3-(trifluoromethyl)pyridine
SMILESFc1cccc(-c2ncccc2C(F)(F)F)c1F
InChIInChI=1S/C12H6F5N/c13-9-5-1-3-7(10(9)14)11-8(12(15,16)17)4-2-6-18-11/h1-6H
InChIKeyYKSAODHIYHLSIC-UHFFFAOYSA-N
MW259.18 g/mol
LogP4.05
Rot. Bonds1

About 2-(2,3-difluorophenyl)-3-(trifluoromethyl)pyridine

2-(2,3-difluorophenyl)-3-(trifluoromethyl)pyridine (PubChem CID 170837725) has the molecular formula C12H6F5N and a molecular weight of 259.18 g/mol. Its IUPAC name is 2-(2,3-difluorophenyl)-3-(trifluoromethyl)pyridine.

Molecular Properties

Compound Name2-(2,3-difluorophenyl)-3-(trifluoromethyl)pyridine
PubChem CID170837725
Molecular FormulaC12H6F5N
Molecular Weight259.18 g/mol
Exact Mass259.04
IUPAC Name2-(2,3-difluorophenyl)-3-(trifluoromethyl)pyridine
SMILESFc1cccc(-c2ncccc2C(F)(F)F)c1F
InChIInChI=1S/C12H6F5N/c13-9-5-1-3-7(10(9)14)11-8(12(15,16)17)4-2-6-18-11/h1-6H
InChIKeyYKSAODHIYHLSIC-UHFFFAOYSA-N
XLogP4.05
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.18
LogP ≤ 54.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 2-(2,3-difluorophenyl)-3-(trifluoromethyl)pyridine 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

2-(2,3-difluorophenyl)-4-(trifluoromethyl)pyridine-3-carbaldehyde
CID 118813601
2-(2,3-difluorophenyl)-4-(trifluoromethyl)pyridine-3-carboxylic acid
CID 118830649
5-(2,3-difluorophenyl)-1,6-naphthyridine
CID 163316334
[2-(2,3-difluorophenyl)-3-(trifluoromethyl)-4-pyridinyl]boronic acid
CID 153320819
3-[2-(trifluoromethyl)phenyl]-2-[2-[2-[3-[2-(trifluoromethyl)phenyl]-2-pyridinyl]phenyl]phenyl]pyridine
CID 58947587
2-(2,3-difluorophenyl)pyrimidine
CID 22717518
2-(2,4,5-trichlorophenyl)-3-(trifluoromethyl)pyridine
CID 118847520
1,2-difluoro-3-[2-methyl-6-(trifluoromethyl)phenyl]benzene
CID 118843388
2-[2,4-bis(trifluoromethyl)phenyl]-3-fluoropyridine
CID 130181953
4-(2,3-difluorophenyl)-5-(trifluoromethyl)pyridin-2-amine
CID 119001740
4-fluoro-3-(trifluoromethyl)-2-[2-(trifluoromethyl)phenyl]pyridine
CID 118850193
4-amino-2-[3-(trifluoromethyl)-2-pyridinyl]phenol
CID 154216867

Frequently Asked Questions

What is the IUPAC name of 2-(2,3-difluorophenyl)-3-(trifluoromethyl)pyridine?
The IUPAC name of 2-(2,3-difluorophenyl)-3-(trifluoromethyl)pyridine (CID 170837725) is 2-(2,3-difluorophenyl)-3-(trifluoromethyl)pyridine.
What is the SMILES notation for 2-(2,3-difluorophenyl)-3-(trifluoromethyl)pyridine?
The canonical SMILES for 2-(2,3-difluorophenyl)-3-(trifluoromethyl)pyridine is Fc1cccc(-c2ncccc2C(F)(F)F)c1F.
What is the InChIKey of 2-(2,3-difluorophenyl)-3-(trifluoromethyl)pyridine?
The InChIKey is YKSAODHIYHLSIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H6F5N/c13-9-5-1-3-7(10(9)14)11-8(12(15,16)17)4-2-6-18-11/h1-6H.
What are the key properties of 2-(2,3-difluorophenyl)-3-(trifluoromethyl)pyridine?
2-(2,3-difluorophenyl)-3-(trifluoromethyl)pyridine has a molecular weight of 259.18 g/mol, XLogP of 4.05, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-difluorophenyl)-3-(trifluoromethyl)pyridine is sourced from PubChem (CID 170837725), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).