2-(2,5-dichlorophenyl)-5-(trifluoromethyl)pyridine

C12H6Cl2F3N — CID 118813630

IUPAC2-(2,5-dichlorophenyl)-5-(trifluoromethyl)pyridine
SMILESFC(F)(F)c1ccc(-c2cc(Cl)ccc2Cl)nc1
InChIInChI=1S/C12H6Cl2F3N/c13-8-2-3-10(14)9(5-8)11-4-1-7(6-18-11)12(15,16)17/h1-6H
InChIKeyFMSCORDREIJXFV-UHFFFAOYSA-N
MW292.09 g/mol
LogP5.07
Rot. Bonds1

About 2-(2,5-dichlorophenyl)-5-(trifluoromethyl)pyridine

2-(2,5-dichlorophenyl)-5-(trifluoromethyl)pyridine (PubChem CID 118813630) has the molecular formula C12H6Cl2F3N and a molecular weight of 292.09 g/mol. Its IUPAC name is 2-(2,5-dichlorophenyl)-5-(trifluoromethyl)pyridine.

Molecular Properties

Compound Name2-(2,5-dichlorophenyl)-5-(trifluoromethyl)pyridine
PubChem CID118813630
Molecular FormulaC12H6Cl2F3N
Molecular Weight292.09 g/mol
Exact Mass290.98
IUPAC Name2-(2,5-dichlorophenyl)-5-(trifluoromethyl)pyridine
SMILESFC(F)(F)c1ccc(-c2cc(Cl)ccc2Cl)nc1
InChIInChI=1S/C12H6Cl2F3N/c13-8-2-3-10(14)9(5-8)11-4-1-7(6-18-11)12(15,16)17/h1-6H
InChIKeyFMSCORDREIJXFV-UHFFFAOYSA-N
XLogP5.07
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500292.09
LogP ≤ 55.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 2-(2,5-dichlorophenyl)-5-(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

Frequently Asked Questions

What is the IUPAC name of 2-(2,5-dichlorophenyl)-5-(trifluoromethyl)pyridine?
The IUPAC name of 2-(2,5-dichlorophenyl)-5-(trifluoromethyl)pyridine (CID 118813630) is 2-(2,5-dichlorophenyl)-5-(trifluoromethyl)pyridine.
What is the SMILES notation for 2-(2,5-dichlorophenyl)-5-(trifluoromethyl)pyridine?
The canonical SMILES for 2-(2,5-dichlorophenyl)-5-(trifluoromethyl)pyridine is FC(F)(F)c1ccc(-c2cc(Cl)ccc2Cl)nc1.
What is the InChIKey of 2-(2,5-dichlorophenyl)-5-(trifluoromethyl)pyridine?
The InChIKey is FMSCORDREIJXFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H6Cl2F3N/c13-8-2-3-10(14)9(5-8)11-4-1-7(6-18-11)12(15,16)17/h1-6H.
What are the key properties of 2-(2,5-dichlorophenyl)-5-(trifluoromethyl)pyridine?
2-(2,5-dichlorophenyl)-5-(trifluoromethyl)pyridine has a molecular weight of 292.09 g/mol, XLogP of 5.07, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,5-dichlorophenyl)-5-(trifluoromethyl)pyridine is sourced from PubChem (CID 118813630), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).