1-(4-methylcyclohexyl)piperidine

C12H23N — CID 13184332

IUPAC1-(4-methylcyclohexyl)piperidine
SMILESCC1CCC(N2CCCCC2)CC1
InChIInChI=1S/C12H23N/c1-11-5-7-12(8-6-11)13-9-3-2-4-10-13/h11-12H,2-10H2,1H3
InChIKeyUCNSPEJUXJWFIY-UHFFFAOYSA-N
MW181.32 g/mol
LogP3.05
Rot. Bonds1

About 1-(4-methylcyclohexyl)piperidine

1-(4-methylcyclohexyl)piperidine (PubChem CID 13184332) has the molecular formula C12H23N and a molecular weight of 181.32 g/mol. Its IUPAC name is 1-(4-methylcyclohexyl)piperidine.

Molecular Properties

Compound Name1-(4-methylcyclohexyl)piperidine
PubChem CID13184332
Molecular FormulaC12H23N
Molecular Weight181.32 g/mol
Exact Mass181.18
IUPAC Name1-(4-methylcyclohexyl)piperidine
SMILESCC1CCC(N2CCCCC2)CC1
InChIInChI=1S/C12H23N/c1-11-5-7-12(8-6-11)13-9-3-2-4-10-13/h11-12H,2-10H2,1H3
InChIKeyUCNSPEJUXJWFIY-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

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Frequently Asked Questions

What is the IUPAC name of 1-(4-methylcyclohexyl)piperidine?
The IUPAC name of 1-(4-methylcyclohexyl)piperidine (CID 13184332) is 1-(4-methylcyclohexyl)piperidine.
What is the SMILES notation for 1-(4-methylcyclohexyl)piperidine?
The canonical SMILES for 1-(4-methylcyclohexyl)piperidine is CC1CCC(N2CCCCC2)CC1.
What is the InChIKey of 1-(4-methylcyclohexyl)piperidine?
The InChIKey is UCNSPEJUXJWFIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N/c1-11-5-7-12(8-6-11)13-9-3-2-4-10-13/h11-12H,2-10H2,1H3.
What are the key properties of 1-(4-methylcyclohexyl)piperidine?
1-(4-methylcyclohexyl)piperidine 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-(4-methylcyclohexyl)piperidine is sourced from PubChem (CID 13184332), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).