1-(3-chlorophenoxy)-4-phenylpiperidine

C17H18ClNO — CID 143724696

IUPAC1-(3-chlorophenoxy)-4-phenylpiperidine
SMILESClc1cccc(ON2CCC(c3ccccc3)CC2)c1
InChIInChI=1S/C17H18ClNO/c18-16-7-4-8-17(13-16)20-19-11-9-15(10-12-19)14-5-2-1-3-6-14/h1-8,13,15H,9-12H2
InChIKeyXJRLJTYHQKALCD-UHFFFAOYSA-N
MW287.79 g/mol
LogP4.51
Rot. Bonds3

About 1-(3-chlorophenoxy)-4-phenylpiperidine

1-(3-chlorophenoxy)-4-phenylpiperidine (PubChem CID 143724696) has the molecular formula C17H18ClNO and a molecular weight of 287.79 g/mol. Its IUPAC name is 1-(3-chlorophenoxy)-4-phenylpiperidine.

Molecular Properties

Compound Name1-(3-chlorophenoxy)-4-phenylpiperidine
PubChem CID143724696
Molecular FormulaC17H18ClNO
Molecular Weight287.79 g/mol
Exact Mass287.11
IUPAC Name1-(3-chlorophenoxy)-4-phenylpiperidine
SMILESClc1cccc(ON2CCC(c3ccccc3)CC2)c1
InChIInChI=1S/C17H18ClNO/c18-16-7-4-8-17(13-16)20-19-11-9-15(10-12-19)14-5-2-1-3-6-14/h1-8,13,15H,9-12H2
InChIKeyXJRLJTYHQKALCD-UHFFFAOYSA-N
XLogP4.51
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.79
LogP ≤ 54.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 1-(3-chlorophenoxy)-4-phenylpiperidine 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 1-(3-chlorophenoxy)-4-phenylpiperidine?
The IUPAC name of 1-(3-chlorophenoxy)-4-phenylpiperidine (CID 143724696) is 1-(3-chlorophenoxy)-4-phenylpiperidine.
What is the SMILES notation for 1-(3-chlorophenoxy)-4-phenylpiperidine?
The canonical SMILES for 1-(3-chlorophenoxy)-4-phenylpiperidine is Clc1cccc(ON2CCC(c3ccccc3)CC2)c1.
What is the InChIKey of 1-(3-chlorophenoxy)-4-phenylpiperidine?
The InChIKey is XJRLJTYHQKALCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18ClNO/c18-16-7-4-8-17(13-16)20-19-11-9-15(10-12-19)14-5-2-1-3-6-14/h1-8,13,15H,9-12H2.
What are the key properties of 1-(3-chlorophenoxy)-4-phenylpiperidine?
1-(3-chlorophenoxy)-4-phenylpiperidine has a molecular weight of 287.79 g/mol, XLogP of 4.51, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-chlorophenoxy)-4-phenylpiperidine is sourced from PubChem (CID 143724696), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).