[4-[(4-chlorophenyl)methyl]piperidin-4-yl]methanol

C13H18ClNO — CID 56749631

IUPAC[4-[(4-chlorophenyl)methyl]piperidin-4-yl]methanol
SMILESOCC1(Cc2ccc(Cl)cc2)CCNCC1
InChIInChI=1S/C13H18ClNO/c14-12-3-1-11(2-4-12)9-13(10-16)5-7-15-8-6-13/h1-4,15-16H,5-10H2
InChIKeyBLVNSUPRSHXLHI-UHFFFAOYSA-N
MW239.75 g/mol
LogP2.24
Rot. Bonds3

About [4-[(4-chlorophenyl)methyl]piperidin-4-yl]methanol

[4-[(4-chlorophenyl)methyl]piperidin-4-yl]methanol (PubChem CID 56749631) has the molecular formula C13H18ClNO and a molecular weight of 239.75 g/mol. Its IUPAC name is [4-[(4-chlorophenyl)methyl]piperidin-4-yl]methanol.

Molecular Properties

Compound Name[4-[(4-chlorophenyl)methyl]piperidin-4-yl]methanol
PubChem CID56749631
Molecular FormulaC13H18ClNO
Molecular Weight239.75 g/mol
Exact Mass239.11
IUPAC Name[4-[(4-chlorophenyl)methyl]piperidin-4-yl]methanol
SMILESOCC1(Cc2ccc(Cl)cc2)CCNCC1
InChIInChI=1S/C13H18ClNO/c14-12-3-1-11(2-4-12)9-13(10-16)5-7-15-8-6-13/h1-4,15-16H,5-10H2
InChIKeyBLVNSUPRSHXLHI-UHFFFAOYSA-N
XLogP2.24
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.75
LogP ≤ 52.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze [4-[(4-chlorophenyl)methyl]piperidin-4-yl]methanol 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-[(4-chlorophenyl)methyl]piperidin-4-yl]methanol?
The IUPAC name of [4-[(4-chlorophenyl)methyl]piperidin-4-yl]methanol (CID 56749631) is [4-[(4-chlorophenyl)methyl]piperidin-4-yl]methanol.
What is the SMILES notation for [4-[(4-chlorophenyl)methyl]piperidin-4-yl]methanol?
The canonical SMILES for [4-[(4-chlorophenyl)methyl]piperidin-4-yl]methanol is OCC1(Cc2ccc(Cl)cc2)CCNCC1.
What is the InChIKey of [4-[(4-chlorophenyl)methyl]piperidin-4-yl]methanol?
The InChIKey is BLVNSUPRSHXLHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18ClNO/c14-12-3-1-11(2-4-12)9-13(10-16)5-7-15-8-6-13/h1-4,15-16H,5-10H2.
What are the key properties of [4-[(4-chlorophenyl)methyl]piperidin-4-yl]methanol?
[4-[(4-chlorophenyl)methyl]piperidin-4-yl]methanol has a molecular weight of 239.75 g/mol, XLogP of 2.24, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[(4-chlorophenyl)methyl]piperidin-4-yl]methanol is sourced from PubChem (CID 56749631), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).