4-phenyl-4-[[3-(trifluoromethyl)phenyl]methoxymethyl]piperidine

C20H22F3NO — CID 10620143

IUPAC4-phenyl-4-[[3-(trifluoromethyl)phenyl]methoxymethyl]piperidine
SMILESFC(F)(F)c1cccc(COCC2(c3ccccc3)CCNCC2)c1
InChIInChI=1S/C20H22F3NO/c21-20(22,23)18-8-4-5-16(13-18)14-25-15-19(9-11-24-12-10-19)17-6-2-1-3-7-17/h1-8,13,24H,9-12,14-15H2
InChIKeyDZUQXMNESQQMDK-UHFFFAOYSA-N
MW349.40 g/mol
LogP4.54
Rot. Bonds5

About 4-phenyl-4-[[3-(trifluoromethyl)phenyl]methoxymethyl]piperidine

4-phenyl-4-[[3-(trifluoromethyl)phenyl]methoxymethyl]piperidine (PubChem CID 10620143) has the molecular formula C20H22F3NO and a molecular weight of 349.40 g/mol. Its IUPAC name is 4-phenyl-4-[[3-(trifluoromethyl)phenyl]methoxymethyl]piperidine.

Molecular Properties

Compound Name4-phenyl-4-[[3-(trifluoromethyl)phenyl]methoxymethyl]piperidine
PubChem CID10620143
Molecular FormulaC20H22F3NO
Molecular Weight349.40 g/mol
Exact Mass349.17
IUPAC Name4-phenyl-4-[[3-(trifluoromethyl)phenyl]methoxymethyl]piperidine
SMILESFC(F)(F)c1cccc(COCC2(c3ccccc3)CCNCC2)c1
InChIInChI=1S/C20H22F3NO/c21-20(22,23)18-8-4-5-16(13-18)14-25-15-19(9-11-24-12-10-19)17-6-2-1-3-7-17/h1-8,13,24H,9-12,14-15H2
InChIKeyDZUQXMNESQQMDK-UHFFFAOYSA-N
XLogP4.54
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.40
LogP ≤ 54.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 4-phenyl-4-[[3-(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-4-[[3-(trifluoromethyl)phenyl]methoxymethyl]piperidine?
The IUPAC name of 4-phenyl-4-[[3-(trifluoromethyl)phenyl]methoxymethyl]piperidine (CID 10620143) is 4-phenyl-4-[[3-(trifluoromethyl)phenyl]methoxymethyl]piperidine.
What is the SMILES notation for 4-phenyl-4-[[3-(trifluoromethyl)phenyl]methoxymethyl]piperidine?
The canonical SMILES for 4-phenyl-4-[[3-(trifluoromethyl)phenyl]methoxymethyl]piperidine is FC(F)(F)c1cccc(COCC2(c3ccccc3)CCNCC2)c1.
What is the InChIKey of 4-phenyl-4-[[3-(trifluoromethyl)phenyl]methoxymethyl]piperidine?
The InChIKey is DZUQXMNESQQMDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22F3NO/c21-20(22,23)18-8-4-5-16(13-18)14-25-15-19(9-11-24-12-10-19)17-6-2-1-3-7-17/h1-8,13,24H,9-12,14-15H2.
What are the key properties of 4-phenyl-4-[[3-(trifluoromethyl)phenyl]methoxymethyl]piperidine?
4-phenyl-4-[[3-(trifluoromethyl)phenyl]methoxymethyl]piperidine has a molecular weight of 349.40 g/mol, XLogP of 4.54, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-phenyl-4-[[3-(trifluoromethyl)phenyl]methoxymethyl]piperidine is sourced from PubChem (CID 10620143), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).