2-[3-(trifluoromethyl)phenyl]quinoline

C16H10F3N — CID 1474714

IUPAC2-[3-(trifluoromethyl)phenyl]quinoline
SMILESFC(F)(F)c1cccc(-c2ccc3ccccc3n2)c1
InChIInChI=1S/C16H10F3N/c17-16(18,19)13-6-3-5-12(10-13)15-9-8-11-4-1-2-7-14(11)20-15/h1-10H
InChIKeyHHYIUGQFXUVOPD-UHFFFAOYSA-N
MW273.26 g/mol
LogP4.92
Rot. Bonds1

About 2-[3-(trifluoromethyl)phenyl]quinoline

2-[3-(trifluoromethyl)phenyl]quinoline (PubChem CID 1474714) has the molecular formula C16H10F3N and a molecular weight of 273.26 g/mol. Its IUPAC name is 2-[3-(trifluoromethyl)phenyl]quinoline.

Molecular Properties

Compound Name2-[3-(trifluoromethyl)phenyl]quinoline
PubChem CID1474714
Molecular FormulaC16H10F3N
Molecular Weight273.26 g/mol
Exact Mass273.08
IUPAC Name2-[3-(trifluoromethyl)phenyl]quinoline
SMILESFC(F)(F)c1cccc(-c2ccc3ccccc3n2)c1
InChIInChI=1S/C16H10F3N/c17-16(18,19)13-6-3-5-12(10-13)15-9-8-11-4-1-2-7-14(11)20-15/h1-10H
InChIKeyHHYIUGQFXUVOPD-UHFFFAOYSA-N
XLogP4.92
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.26
LogP ≤ 54.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 2-[3-(trifluoromethyl)phenyl]quinoline 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-[3-(trifluoromethyl)phenyl]quinoline?
The IUPAC name of 2-[3-(trifluoromethyl)phenyl]quinoline (CID 1474714) is 2-[3-(trifluoromethyl)phenyl]quinoline.
What is the SMILES notation for 2-[3-(trifluoromethyl)phenyl]quinoline?
The canonical SMILES for 2-[3-(trifluoromethyl)phenyl]quinoline is FC(F)(F)c1cccc(-c2ccc3ccccc3n2)c1.
What is the InChIKey of 2-[3-(trifluoromethyl)phenyl]quinoline?
The InChIKey is HHYIUGQFXUVOPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H10F3N/c17-16(18,19)13-6-3-5-12(10-13)15-9-8-11-4-1-2-7-14(11)20-15/h1-10H.
What are the key properties of 2-[3-(trifluoromethyl)phenyl]quinoline?
2-[3-(trifluoromethyl)phenyl]quinoline has a molecular weight of 273.26 g/mol, XLogP of 4.92, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(trifluoromethyl)phenyl]quinoline is sourced from PubChem (CID 1474714), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).