1-cyclopentyl-2,6-bis(piperidin-1-ylmethyl)cyclohexan-1-ol

C23H42N2O — CID 10215625

IUPAC1-cyclopentyl-2,6-bis(piperidin-1-ylmethyl)cyclohexan-1-ol
SMILESOC1(C2CCCC2)C(CN2CCCCC2)CCCC1CN1CCCCC1
InChIInChI=1S/C23H42N2O/c26-23(20-10-3-4-11-20)21(18-24-14-5-1-6-15-24)12-9-13-22(23)19-25-16-7-2-8-17-25/h20-22,26H,1-19H2
InChIKeyLWIHYWTXSLEZIO-UHFFFAOYSA-N
MW362.60 g/mol
LogP4.30
Rot. Bonds5

About 1-cyclopentyl-2,6-bis(piperidin-1-ylmethyl)cyclohexan-1-ol

1-cyclopentyl-2,6-bis(piperidin-1-ylmethyl)cyclohexan-1-ol (PubChem CID 10215625) has the molecular formula C23H42N2O and a molecular weight of 362.60 g/mol. Its IUPAC name is 1-cyclopentyl-2,6-bis(piperidin-1-ylmethyl)cyclohexan-1-ol.

Molecular Properties

Compound Name1-cyclopentyl-2,6-bis(piperidin-1-ylmethyl)cyclohexan-1-ol
PubChem CID10215625
Molecular FormulaC23H42N2O
Molecular Weight362.60 g/mol
Exact Mass362.33
IUPAC Name1-cyclopentyl-2,6-bis(piperidin-1-ylmethyl)cyclohexan-1-ol
SMILESOC1(C2CCCC2)C(CN2CCCCC2)CCCC1CN1CCCCC1
InChIInChI=1S/C23H42N2O/c26-23(20-10-3-4-11-20)21(18-24-14-5-1-6-15-24)12-9-13-22(23)19-25-16-7-2-8-17-25/h20-22,26H,1-19H2
InChIKeyLWIHYWTXSLEZIO-UHFFFAOYSA-N
XLogP4.30
TPSA26.71 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.60
LogP ≤ 54.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-cyclopentyl-2,6-bis(piperidin-1-ylmethyl)cyclohexan-1-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-cyclopentyl-2,6-bis(piperidin-1-ylmethyl)cyclohexan-1-ol?
The IUPAC name of 1-cyclopentyl-2,6-bis(piperidin-1-ylmethyl)cyclohexan-1-ol (CID 10215625) is 1-cyclopentyl-2,6-bis(piperidin-1-ylmethyl)cyclohexan-1-ol.
What is the SMILES notation for 1-cyclopentyl-2,6-bis(piperidin-1-ylmethyl)cyclohexan-1-ol?
The canonical SMILES for 1-cyclopentyl-2,6-bis(piperidin-1-ylmethyl)cyclohexan-1-ol is OC1(C2CCCC2)C(CN2CCCCC2)CCCC1CN1CCCCC1.
What is the InChIKey of 1-cyclopentyl-2,6-bis(piperidin-1-ylmethyl)cyclohexan-1-ol?
The InChIKey is LWIHYWTXSLEZIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H42N2O/c26-23(20-10-3-4-11-20)21(18-24-14-5-1-6-15-24)12-9-13-22(23)19-25-16-7-2-8-17-25/h20-22,26H,1-19H2.
What are the key properties of 1-cyclopentyl-2,6-bis(piperidin-1-ylmethyl)cyclohexan-1-ol?
1-cyclopentyl-2,6-bis(piperidin-1-ylmethyl)cyclohexan-1-ol has a molecular weight of 362.60 g/mol, XLogP of 4.30, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopentyl-2,6-bis(piperidin-1-ylmethyl)cyclohexan-1-ol is sourced from PubChem (CID 10215625), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).