2-(4-methylcyclohexyl)piperidine

C12H23N — CID 3020571

IUPAC2-(4-methylcyclohexyl)piperidine
SMILESCC1CCC(C2CCCCN2)CC1
InChIInChI=1S/C12H23N/c1-10-5-7-11(8-6-10)12-4-2-3-9-13-12/h10-13H,2-9H2,1H3
InChIKeyJBVLZTOPFKHUJA-UHFFFAOYSA-N
MW181.32 g/mol
LogP2.95
Rot. Bonds1

About 2-(4-methylcyclohexyl)piperidine

2-(4-methylcyclohexyl)piperidine (PubChem CID 3020571) has the molecular formula C12H23N and a molecular weight of 181.32 g/mol. Its IUPAC name is 2-(4-methylcyclohexyl)piperidine.

Molecular Properties

Compound Name2-(4-methylcyclohexyl)piperidine
PubChem CID3020571
Molecular FormulaC12H23N
Molecular Weight181.32 g/mol
Exact Mass181.18
IUPAC Name2-(4-methylcyclohexyl)piperidine
SMILESCC1CCC(C2CCCCN2)CC1
InChIInChI=1S/C12H23N/c1-10-5-7-11(8-6-10)12-4-2-3-9-13-12/h10-13H,2-9H2,1H3
InChIKeyJBVLZTOPFKHUJA-UHFFFAOYSA-N
XLogP2.95
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.32
LogP ≤ 52.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 2-(4-methylcyclohexyl)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 2-(4-methylcyclohexyl)piperidine?
The IUPAC name of 2-(4-methylcyclohexyl)piperidine (CID 3020571) is 2-(4-methylcyclohexyl)piperidine.
What is the SMILES notation for 2-(4-methylcyclohexyl)piperidine?
The canonical SMILES for 2-(4-methylcyclohexyl)piperidine is CC1CCC(C2CCCCN2)CC1.
What is the InChIKey of 2-(4-methylcyclohexyl)piperidine?
The InChIKey is JBVLZTOPFKHUJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N/c1-10-5-7-11(8-6-10)12-4-2-3-9-13-12/h10-13H,2-9H2,1H3.
What are the key properties of 2-(4-methylcyclohexyl)piperidine?
2-(4-methylcyclohexyl)piperidine has a molecular weight of 181.32 g/mol, XLogP of 2.95, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methylcyclohexyl)piperidine is sourced from PubChem (CID 3020571), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).