4-phenyl-1-[[4-(trifluoromethyl)phenyl]methoxymethyl]piperidine

C20H22F3NO — CID 19960260

IUPAC4-phenyl-1-[[4-(trifluoromethyl)phenyl]methoxymethyl]piperidine
SMILESFC(F)(F)c1ccc(COCN2CCC(c3ccccc3)CC2)cc1
InChIInChI=1S/C20H22F3NO/c21-20(22,23)19-8-6-16(7-9-19)14-25-15-24-12-10-18(11-13-24)17-4-2-1-3-5-17/h1-9,18H,10-15H2
InChIKeyOQFIRYHSTJMEFZ-UHFFFAOYSA-N
MW349.40 g/mol
LogP5.06
Rot. Bonds5

About 4-phenyl-1-[[4-(trifluoromethyl)phenyl]methoxymethyl]piperidine

4-phenyl-1-[[4-(trifluoromethyl)phenyl]methoxymethyl]piperidine (PubChem CID 19960260) has the molecular formula C20H22F3NO and a molecular weight of 349.40 g/mol. Its IUPAC name is 4-phenyl-1-[[4-(trifluoromethyl)phenyl]methoxymethyl]piperidine.

Molecular Properties

Compound Name4-phenyl-1-[[4-(trifluoromethyl)phenyl]methoxymethyl]piperidine
PubChem CID19960260
Molecular FormulaC20H22F3NO
Molecular Weight349.40 g/mol
Exact Mass349.17
IUPAC Name4-phenyl-1-[[4-(trifluoromethyl)phenyl]methoxymethyl]piperidine
SMILESFC(F)(F)c1ccc(COCN2CCC(c3ccccc3)CC2)cc1
InChIInChI=1S/C20H22F3NO/c21-20(22,23)19-8-6-16(7-9-19)14-25-15-24-12-10-18(11-13-24)17-4-2-1-3-5-17/h1-9,18H,10-15H2
InChIKeyOQFIRYHSTJMEFZ-UHFFFAOYSA-N
XLogP5.06
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500349.40
LogP ≤ 55.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 4-phenyl-1-[[4-(trifluoromethyl)phenyl]methoxymethyl]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 4-phenyl-1-[[4-(trifluoromethyl)phenyl]methoxymethyl]piperidine?
The IUPAC name of 4-phenyl-1-[[4-(trifluoromethyl)phenyl]methoxymethyl]piperidine (CID 19960260) is 4-phenyl-1-[[4-(trifluoromethyl)phenyl]methoxymethyl]piperidine.
What is the SMILES notation for 4-phenyl-1-[[4-(trifluoromethyl)phenyl]methoxymethyl]piperidine?
The canonical SMILES for 4-phenyl-1-[[4-(trifluoromethyl)phenyl]methoxymethyl]piperidine is FC(F)(F)c1ccc(COCN2CCC(c3ccccc3)CC2)cc1.
What is the InChIKey of 4-phenyl-1-[[4-(trifluoromethyl)phenyl]methoxymethyl]piperidine?
The InChIKey is OQFIRYHSTJMEFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22F3NO/c21-20(22,23)19-8-6-16(7-9-19)14-25-15-24-12-10-18(11-13-24)17-4-2-1-3-5-17/h1-9,18H,10-15H2.
What are the key properties of 4-phenyl-1-[[4-(trifluoromethyl)phenyl]methoxymethyl]piperidine?
4-phenyl-1-[[4-(trifluoromethyl)phenyl]methoxymethyl]piperidine has a molecular weight of 349.40 g/mol, XLogP of 5.06, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-phenyl-1-[[4-(trifluoromethyl)phenyl]methoxymethyl]piperidine is sourced from PubChem (CID 19960260), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).