4-methyl-1-[2-(4-methylcyclohexyl)ethyl]piperidine

C15H29N — CID 129059218

IUPAC4-methyl-1-[2-(4-methylcyclohexyl)ethyl]piperidine
SMILESCC1CCC(CCN2CCC(C)CC2)CC1
InChIInChI=1S/C15H29N/c1-13-3-5-15(6-4-13)9-12-16-10-7-14(2)8-11-16/h13-15H,3-12H2,1-2H3
InChIKeyPZNRAKULBADVQT-UHFFFAOYSA-N
MW223.40 g/mol
LogP3.93
Rot. Bonds3

About 4-methyl-1-[2-(4-methylcyclohexyl)ethyl]piperidine

4-methyl-1-[2-(4-methylcyclohexyl)ethyl]piperidine (PubChem CID 129059218) has the molecular formula C15H29N and a molecular weight of 223.40 g/mol. Its IUPAC name is 4-methyl-1-[2-(4-methylcyclohexyl)ethyl]piperidine.

Molecular Properties

Compound Name4-methyl-1-[2-(4-methylcyclohexyl)ethyl]piperidine
PubChem CID129059218
Molecular FormulaC15H29N
Molecular Weight223.40 g/mol
Exact Mass223.23
IUPAC Name4-methyl-1-[2-(4-methylcyclohexyl)ethyl]piperidine
SMILESCC1CCC(CCN2CCC(C)CC2)CC1
InChIInChI=1S/C15H29N/c1-13-3-5-15(6-4-13)9-12-16-10-7-14(2)8-11-16/h13-15H,3-12H2,1-2H3
InChIKeyPZNRAKULBADVQT-UHFFFAOYSA-N
XLogP3.93
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.40
LogP ≤ 53.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of 4-methyl-1-[2-(4-methylcyclohexyl)ethyl]piperidine?
The IUPAC name of 4-methyl-1-[2-(4-methylcyclohexyl)ethyl]piperidine (CID 129059218) is 4-methyl-1-[2-(4-methylcyclohexyl)ethyl]piperidine.
What is the SMILES notation for 4-methyl-1-[2-(4-methylcyclohexyl)ethyl]piperidine?
The canonical SMILES for 4-methyl-1-[2-(4-methylcyclohexyl)ethyl]piperidine is CC1CCC(CCN2CCC(C)CC2)CC1.
What is the InChIKey of 4-methyl-1-[2-(4-methylcyclohexyl)ethyl]piperidine?
The InChIKey is PZNRAKULBADVQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29N/c1-13-3-5-15(6-4-13)9-12-16-10-7-14(2)8-11-16/h13-15H,3-12H2,1-2H3.
What are the key properties of 4-methyl-1-[2-(4-methylcyclohexyl)ethyl]piperidine?
4-methyl-1-[2-(4-methylcyclohexyl)ethyl]piperidine has a molecular weight of 223.40 g/mol, XLogP of 3.93, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-1-[2-(4-methylcyclohexyl)ethyl]piperidine is sourced from PubChem (CID 129059218), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).