2-[4-(trifluoromethyl)phenyl]piperidine

C12H14F3N — CID 3911556

IUPAC2-[4-(trifluoromethyl)phenyl]piperidine
SMILESFC(F)(F)c1ccc(C2CCCCN2)cc1
InChIInChI=1S/C12H14F3N/c13-12(14,15)10-6-4-9(5-7-10)11-3-1-2-8-16-11/h4-7,11,16H,1-3,8H2
InChIKeyBPIPNPGHOKSKPH-UHFFFAOYSA-N
MW229.25 g/mol
LogP3.52
Rot. Bonds1

About 2-[4-(trifluoromethyl)phenyl]piperidine

2-[4-(trifluoromethyl)phenyl]piperidine (PubChem CID 3911556) has the molecular formula C12H14F3N and a molecular weight of 229.25 g/mol. Its IUPAC name is 2-[4-(trifluoromethyl)phenyl]piperidine.

Molecular Properties

Compound Name2-[4-(trifluoromethyl)phenyl]piperidine
PubChem CID3911556
Molecular FormulaC12H14F3N
Molecular Weight229.25 g/mol
Exact Mass229.11
IUPAC Name2-[4-(trifluoromethyl)phenyl]piperidine
SMILESFC(F)(F)c1ccc(C2CCCCN2)cc1
InChIInChI=1S/C12H14F3N/c13-12(14,15)10-6-4-9(5-7-10)11-3-1-2-8-16-11/h4-7,11,16H,1-3,8H2
InChIKeyBPIPNPGHOKSKPH-UHFFFAOYSA-N
XLogP3.52
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.25
LogP ≤ 53.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 2-[4-(trifluoromethyl)phenyl]piperidine 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-[4-(trifluoromethyl)phenyl]piperidine?
The IUPAC name of 2-[4-(trifluoromethyl)phenyl]piperidine (CID 3911556) is 2-[4-(trifluoromethyl)phenyl]piperidine.
What is the SMILES notation for 2-[4-(trifluoromethyl)phenyl]piperidine?
The canonical SMILES for 2-[4-(trifluoromethyl)phenyl]piperidine is FC(F)(F)c1ccc(C2CCCCN2)cc1.
What is the InChIKey of 2-[4-(trifluoromethyl)phenyl]piperidine?
The InChIKey is BPIPNPGHOKSKPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14F3N/c13-12(14,15)10-6-4-9(5-7-10)11-3-1-2-8-16-11/h4-7,11,16H,1-3,8H2.
What are the key properties of 2-[4-(trifluoromethyl)phenyl]piperidine?
2-[4-(trifluoromethyl)phenyl]piperidine has a molecular weight of 229.25 g/mol, XLogP of 3.52, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(trifluoromethyl)phenyl]piperidine is sourced from PubChem (CID 3911556), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).