1-cyclohexyl-4-methylpiperidine

C12H23N — CID 20758846

IUPAC1-cyclohexyl-4-methylpiperidine
SMILESCC1CCN(C2CCCCC2)CC1
InChIInChI=1S/C12H23N/c1-11-7-9-13(10-8-11)12-5-3-2-4-6-12/h11-12H,2-10H2,1H3
InChIKeyVEJFSCWBIROGBV-UHFFFAOYSA-N
MW181.32 g/mol
LogP3.05
Rot. Bonds1

About 1-cyclohexyl-4-methylpiperidine

1-cyclohexyl-4-methylpiperidine (PubChem CID 20758846) has the molecular formula C12H23N and a molecular weight of 181.32 g/mol. Its IUPAC name is 1-cyclohexyl-4-methylpiperidine.

Molecular Properties

Compound Name1-cyclohexyl-4-methylpiperidine
PubChem CID20758846
Molecular FormulaC12H23N
Molecular Weight181.32 g/mol
Exact Mass181.18
IUPAC Name1-cyclohexyl-4-methylpiperidine
SMILESCC1CCN(C2CCCCC2)CC1
InChIInChI=1S/C12H23N/c1-11-7-9-13(10-8-11)12-5-3-2-4-6-12/h11-12H,2-10H2,1H3
InChIKeyVEJFSCWBIROGBV-UHFFFAOYSA-N
XLogP3.05
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.32
LogP ≤ 53.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 1-cyclohexyl-4-methylpiperidine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-Cyclohexylpiperidine
CID 18724
Leptacline
CID 71660
N,1-dimethyl-N-(4-methylcyclohexyl)-4-piperidinamine
CID 2846435
1-Cyclohexylmethyl-4-methyl-piperidine
CID 15153359
1-Ethyl-4-methylpiperidine
CID 4178649
1-Butyl-4-methylpiperidine
CID 4104802
1-Hexyl-4-methylpiperidine
CID 4525600
Piperidine, 1-(1-ethylcyclohexyl)-
CID 202078
Piperidine, 1-(1-butylcyclohexyl)-
CID 203370
1-Propyl-4-methylpiperidine
CID 4100429
Piperazine, 1-ethyl-4-(4-methylcyclohexyl)-(9CI)
CID 784289
1,2,5-Trimethylpiperidine
CID 338922

Frequently Asked Questions

What is the IUPAC name of 1-cyclohexyl-4-methylpiperidine?
The IUPAC name of 1-cyclohexyl-4-methylpiperidine (CID 20758846) is 1-cyclohexyl-4-methylpiperidine.
What is the SMILES notation for 1-cyclohexyl-4-methylpiperidine?
The canonical SMILES for 1-cyclohexyl-4-methylpiperidine is CC1CCN(C2CCCCC2)CC1.
What is the InChIKey of 1-cyclohexyl-4-methylpiperidine?
The InChIKey is VEJFSCWBIROGBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N/c1-11-7-9-13(10-8-11)12-5-3-2-4-6-12/h11-12H,2-10H2,1H3.
What are the key properties of 1-cyclohexyl-4-methylpiperidine?
1-cyclohexyl-4-methylpiperidine has a molecular weight of 181.32 g/mol, XLogP of 3.05, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-4-methylpiperidine is sourced from PubChem (CID 20758846), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).