1-benzyl-4-(4-chlorophenyl)piperidin-4-ol

C18H20ClNO — CID 15907328

IUPAC1-benzyl-4-(4-chlorophenyl)piperidin-4-ol
SMILESOC1(c2ccc(Cl)cc2)CCN(Cc2ccccc2)CC1
InChIInChI=1S/C18H20ClNO/c19-17-8-6-16(7-9-17)18(21)10-12-20(13-11-18)14-15-4-2-1-3-5-15/h1-9,21H,10-14H2
InChIKeyNGJGWNDBSJUZQU-UHFFFAOYSA-N
MW301.82 g/mol
LogP3.82
Rot. Bonds3

About 1-benzyl-4-(4-chlorophenyl)piperidin-4-ol

1-benzyl-4-(4-chlorophenyl)piperidin-4-ol (PubChem CID 15907328) has the molecular formula C18H20ClNO and a molecular weight of 301.82 g/mol. Its IUPAC name is 1-benzyl-4-(4-chlorophenyl)piperidin-4-ol.

Molecular Properties

Compound Name1-benzyl-4-(4-chlorophenyl)piperidin-4-ol
PubChem CID15907328
Molecular FormulaC18H20ClNO
Molecular Weight301.82 g/mol
Exact Mass301.12
IUPAC Name1-benzyl-4-(4-chlorophenyl)piperidin-4-ol
SMILESOC1(c2ccc(Cl)cc2)CCN(Cc2ccccc2)CC1
InChIInChI=1S/C18H20ClNO/c19-17-8-6-16(7-9-17)18(21)10-12-20(13-11-18)14-15-4-2-1-3-5-15/h1-9,21H,10-14H2
InChIKeyNGJGWNDBSJUZQU-UHFFFAOYSA-N
XLogP3.82
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.82
LogP ≤ 53.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-benzyl-4-(4-chlorophenyl)piperidin-4-ol 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-benzyl-4-(4-chlorophenyl)piperidin-4-ol?
The IUPAC name of 1-benzyl-4-(4-chlorophenyl)piperidin-4-ol (CID 15907328) is 1-benzyl-4-(4-chlorophenyl)piperidin-4-ol.
What is the SMILES notation for 1-benzyl-4-(4-chlorophenyl)piperidin-4-ol?
The canonical SMILES for 1-benzyl-4-(4-chlorophenyl)piperidin-4-ol is OC1(c2ccc(Cl)cc2)CCN(Cc2ccccc2)CC1.
What is the InChIKey of 1-benzyl-4-(4-chlorophenyl)piperidin-4-ol?
The InChIKey is NGJGWNDBSJUZQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20ClNO/c19-17-8-6-16(7-9-17)18(21)10-12-20(13-11-18)14-15-4-2-1-3-5-15/h1-9,21H,10-14H2.
What are the key properties of 1-benzyl-4-(4-chlorophenyl)piperidin-4-ol?
1-benzyl-4-(4-chlorophenyl)piperidin-4-ol has a molecular weight of 301.82 g/mol, XLogP of 3.82, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzyl-4-(4-chlorophenyl)piperidin-4-ol is sourced from PubChem (CID 15907328), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).