1-(4,4-dimethylcyclohexyl)-4-methylpiperidine

C14H27N — CID 18724080

IUPAC1-(4,4-dimethylcyclohexyl)-4-methylpiperidine
SMILESCC1CCN(C2CCC(C)(C)CC2)CC1
InChIInChI=1S/C14H27N/c1-12-6-10-15(11-7-12)13-4-8-14(2,3)9-5-13/h12-13H,4-11H2,1-3H3
InChIKeyXESUPFIGEOCEKF-UHFFFAOYSA-N
MW209.38 g/mol
LogP3.69
Rot. Bonds1

About 1-(4,4-dimethylcyclohexyl)-4-methylpiperidine

1-(4,4-dimethylcyclohexyl)-4-methylpiperidine (PubChem CID 18724080) has the molecular formula C14H27N and a molecular weight of 209.38 g/mol. Its IUPAC name is 1-(4,4-dimethylcyclohexyl)-4-methylpiperidine.

Molecular Properties

Compound Name1-(4,4-dimethylcyclohexyl)-4-methylpiperidine
PubChem CID18724080
Molecular FormulaC14H27N
Molecular Weight209.38 g/mol
Exact Mass209.21
IUPAC Name1-(4,4-dimethylcyclohexyl)-4-methylpiperidine
SMILESCC1CCN(C2CCC(C)(C)CC2)CC1
InChIInChI=1S/C14H27N/c1-12-6-10-15(11-7-12)13-4-8-14(2,3)9-5-13/h12-13H,4-11H2,1-3H3
InChIKeyXESUPFIGEOCEKF-UHFFFAOYSA-N
XLogP3.69
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.38
LogP ≤ 53.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-(4,4-dimethylcyclohexyl)-4-methylpiperidine?
The IUPAC name of 1-(4,4-dimethylcyclohexyl)-4-methylpiperidine (CID 18724080) is 1-(4,4-dimethylcyclohexyl)-4-methylpiperidine.
What is the SMILES notation for 1-(4,4-dimethylcyclohexyl)-4-methylpiperidine?
The canonical SMILES for 1-(4,4-dimethylcyclohexyl)-4-methylpiperidine is CC1CCN(C2CCC(C)(C)CC2)CC1.
What is the InChIKey of 1-(4,4-dimethylcyclohexyl)-4-methylpiperidine?
The InChIKey is XESUPFIGEOCEKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27N/c1-12-6-10-15(11-7-12)13-4-8-14(2,3)9-5-13/h12-13H,4-11H2,1-3H3.
What are the key properties of 1-(4,4-dimethylcyclohexyl)-4-methylpiperidine?
1-(4,4-dimethylcyclohexyl)-4-methylpiperidine has a molecular weight of 209.38 g/mol, XLogP of 3.69, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4,4-dimethylcyclohexyl)-4-methylpiperidine is sourced from PubChem (CID 18724080), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).