2-(4-cyclohexylcyclohexyl)piperidine

C17H31N — CID 83404287

IUPAC2-(4-cyclohexylcyclohexyl)piperidine
SMILESC1CCC(C2CCC(C3CCCCN3)CC2)CC1
InChIInChI=1S/C17H31N/c1-2-6-14(7-3-1)15-9-11-16(12-10-15)17-8-4-5-13-18-17/h14-18H,1-13H2
InChIKeyPMDIKXMRHPCZGU-UHFFFAOYSA-N
MW249.44 g/mol
LogP4.52
Rot. Bonds2

About 2-(4-cyclohexylcyclohexyl)piperidine

2-(4-cyclohexylcyclohexyl)piperidine (PubChem CID 83404287) has the molecular formula C17H31N and a molecular weight of 249.44 g/mol. Its IUPAC name is 2-(4-cyclohexylcyclohexyl)piperidine.

Molecular Properties

Compound Name2-(4-cyclohexylcyclohexyl)piperidine
PubChem CID83404287
Molecular FormulaC17H31N
Molecular Weight249.44 g/mol
Exact Mass249.25
IUPAC Name2-(4-cyclohexylcyclohexyl)piperidine
SMILESC1CCC(C2CCC(C3CCCCN3)CC2)CC1
InChIInChI=1S/C17H31N/c1-2-6-14(7-3-1)15-9-11-16(12-10-15)17-8-4-5-13-18-17/h14-18H,1-13H2
InChIKeyPMDIKXMRHPCZGU-UHFFFAOYSA-N
XLogP4.52
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.44
LogP ≤ 54.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(2S)-2-cyclohexylpiperidine
CID 7016471
2-cyclodecylazecane
CID 126739440
2-cycloheptylpiperidine;hydrochloride
CID 115030388
(5aR,9aR)-2,3,4,5,5a,6,7,8,9,9a-decahydro-1H-benzo[b]azepine
CID 92720077
2-cycloheptylpyrrolidine;hydrochloride
CID 115023231
2-cyclopentylpyrrolidine
CID 4031549
2,3,4,4a,5,6,7,8,9,9a-decahydro-1H-cyclohepta[b]pyridine;ethane
CID 142196659
CID 174042900
CID 174042900
2-piperidin-4-ylpiperidine;dihydrochloride
CID 86100620
2-pyrrolidin-2-ylpiperidine
CID 14810994
6-methyl-2-(5-methylcyclononyl)azonane
CID 146602825
(2S)-2-[4-(azacyclododec-2-yl)cyclohexyl]-1-methyl-azacyclododecane
CID 90429318

Frequently Asked Questions

What is the IUPAC name of 2-(4-cyclohexylcyclohexyl)piperidine?
The IUPAC name of 2-(4-cyclohexylcyclohexyl)piperidine (CID 83404287) is 2-(4-cyclohexylcyclohexyl)piperidine.
What is the SMILES notation for 2-(4-cyclohexylcyclohexyl)piperidine?
The canonical SMILES for 2-(4-cyclohexylcyclohexyl)piperidine is C1CCC(C2CCC(C3CCCCN3)CC2)CC1.
What is the InChIKey of 2-(4-cyclohexylcyclohexyl)piperidine?
The InChIKey is PMDIKXMRHPCZGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H31N/c1-2-6-14(7-3-1)15-9-11-16(12-10-15)17-8-4-5-13-18-17/h14-18H,1-13H2.
What are the key properties of 2-(4-cyclohexylcyclohexyl)piperidine?
2-(4-cyclohexylcyclohexyl)piperidine has a molecular weight of 249.44 g/mol, XLogP of 4.52, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-cyclohexylcyclohexyl)piperidine is sourced from PubChem (CID 83404287), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).