2-(3,4-dimethylcyclohexyl)-5-methylpiperidine

C14H27N — CID 106779509

IUPAC2-(3,4-dimethylcyclohexyl)-5-methylpiperidine
SMILESCC1CCC(C2CCC(C)C(C)C2)NC1
InChIInChI=1S/C14H27N/c1-10-4-7-14(15-9-10)13-6-5-11(2)12(3)8-13/h10-15H,4-9H2,1-3H3
InChIKeyIYAIQKQRBXGPNJ-UHFFFAOYSA-N
MW209.38 g/mol
LogP3.45
Rot. Bonds1

About 2-(3,4-dimethylcyclohexyl)-5-methylpiperidine

2-(3,4-dimethylcyclohexyl)-5-methylpiperidine (PubChem CID 106779509) has the molecular formula C14H27N and a molecular weight of 209.38 g/mol. Its IUPAC name is 2-(3,4-dimethylcyclohexyl)-5-methylpiperidine.

Molecular Properties

Compound Name2-(3,4-dimethylcyclohexyl)-5-methylpiperidine
PubChem CID106779509
Molecular FormulaC14H27N
Molecular Weight209.38 g/mol
Exact Mass209.21
IUPAC Name2-(3,4-dimethylcyclohexyl)-5-methylpiperidine
SMILESCC1CCC(C2CCC(C)C(C)C2)NC1
InChIInChI=1S/C14H27N/c1-10-4-7-14(15-9-10)13-6-5-11(2)12(3)8-13/h10-15H,4-9H2,1-3H3
InChIKeyIYAIQKQRBXGPNJ-UHFFFAOYSA-N
XLogP3.45
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.38
LogP ≤ 53.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

5-methyl-2-piperidin-4-ylpiperidine
CID 57049710
trans-(2R,4R)-1,2-dimethyl-4-(4-methylcyclohexyl)cyclohexane
CID 59970721
4-(3,4-dimethylcyclohexyl)pyrazolidine;ethene
CID 144846797
(2R,5S)-2-(4,4-difluorocyclohexyl)-5-methylpiperidine
CID 169114303
5-methyl-2,3,3a,4,5,6,7,7a-octahydro-1H-indole
CID 70336035
6-(5-methylpiperidin-2-yl)spiro[3.3]heptan-2-ol
CID 170904522
4-(3,4-dimethylcyclohexyl)-2-methylpiperidine
CID 106779525
1,2,4,7-tetramethylcyclononane
CID 123661715
6-methyl-1,2,3,4,4a,5,6,7,8,8a-decahydroquinoline;hydrochloride
CID 155858923
1-[3-[(2R,5S)-5-methylpiperidin-2-yl]piperidin-1-yl]ethanone
CID 164751842
2,5-dimethylpiperidine;ethane;2-fluoro-1,4-dimethylcyclohexane
CID 143128192
2-(3,4-dimethylcyclohexyl)-2,5-dihydro-1H-pyrrole
CID 130510766

Frequently Asked Questions

What is the IUPAC name of 2-(3,4-dimethylcyclohexyl)-5-methylpiperidine?
The IUPAC name of 2-(3,4-dimethylcyclohexyl)-5-methylpiperidine (CID 106779509) is 2-(3,4-dimethylcyclohexyl)-5-methylpiperidine.
What is the SMILES notation for 2-(3,4-dimethylcyclohexyl)-5-methylpiperidine?
The canonical SMILES for 2-(3,4-dimethylcyclohexyl)-5-methylpiperidine is CC1CCC(C2CCC(C)C(C)C2)NC1.
What is the InChIKey of 2-(3,4-dimethylcyclohexyl)-5-methylpiperidine?
The InChIKey is IYAIQKQRBXGPNJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27N/c1-10-4-7-14(15-9-10)13-6-5-11(2)12(3)8-13/h10-15H,4-9H2,1-3H3.
What are the key properties of 2-(3,4-dimethylcyclohexyl)-5-methylpiperidine?
2-(3,4-dimethylcyclohexyl)-5-methylpiperidine has a molecular weight of 209.38 g/mol, XLogP of 3.45, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,4-dimethylcyclohexyl)-5-methylpiperidine is sourced from PubChem (CID 106779509), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).