2-(2-cyclopentyl-2-methylhex-5-enyl)piperidine

C17H31N — CID 58418700

IUPAC2-(2-cyclopentyl-2-methylhex-5-enyl)piperidine
SMILESC=CCCC(C)(CC1CCCCN1)C1CCCC1
InChIInChI=1S/C17H31N/c1-3-4-12-17(2,15-9-5-6-10-15)14-16-11-7-8-13-18-16/h3,15-16,18H,1,4-14H2,2H3
InChIKeyOWNNMQHVLYEPTA-UHFFFAOYSA-N
MW249.44 g/mol
LogP4.68
Rot. Bonds6

About 2-(2-cyclopentyl-2-methylhex-5-enyl)piperidine

2-(2-cyclopentyl-2-methylhex-5-enyl)piperidine (PubChem CID 58418700) has the molecular formula C17H31N and a molecular weight of 249.44 g/mol. Its IUPAC name is 2-(2-cyclopentyl-2-methylhex-5-enyl)piperidine.

Molecular Properties

Compound Name2-(2-cyclopentyl-2-methylhex-5-enyl)piperidine
PubChem CID58418700
Molecular FormulaC17H31N
Molecular Weight249.44 g/mol
Exact Mass249.25
IUPAC Name2-(2-cyclopentyl-2-methylhex-5-enyl)piperidine
SMILESC=CCCC(C)(CC1CCCCN1)C1CCCC1
InChIInChI=1S/C17H31N/c1-3-4-12-17(2,15-9-5-6-10-15)14-16-11-7-8-13-18-16/h3,15-16,18H,1,4-14H2,2H3
InChIKeyOWNNMQHVLYEPTA-UHFFFAOYSA-N
XLogP4.68
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.44
LogP ≤ 54.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

2-piperidin-2-ylhex-5-en-2-ol
CID 104656204
2-hept-6-enylpiperidine
CID 107010178
2-(2-fluoro-2-methylbut-3-enyl)pyrrolidine
CID 131064786
N-methyl-N-(piperidin-2-ylmethyl)hept-6-en-1-amine
CID 107008102
2-[2-fluoro-2-(3-methylcyclohexyl)propyl]piperidine
CID 113462336
2-methyl-N,N-bis(piperidin-2-ylmethyl)propan-2-amine
CID 5252100
2-methyl-4-[(2S)-piperidin-2-yl]butan-2-ol
CID 143395873
2-prop-2-enyl(213C)azolidine
CID 173137372
2-(4-methoxy-4-methylpentyl)piperidine
CID 121009823
2-cyclobutyl-2-methyl-N-(piperidin-2-ylmethyl)propan-1-amine
CID 115209472
(2S,3R)-4,4-dimethyl-1-[(2R)-piperidin-2-yl]pentane-2,3-diol
CID 11746013
2-(2-fluoro-2-methylbutyl)pyrrolidine
CID 105431305

Frequently Asked Questions

What is the IUPAC name of 2-(2-cyclopentyl-2-methylhex-5-enyl)piperidine?
The IUPAC name of 2-(2-cyclopentyl-2-methylhex-5-enyl)piperidine (CID 58418700) is 2-(2-cyclopentyl-2-methylhex-5-enyl)piperidine.
What is the SMILES notation for 2-(2-cyclopentyl-2-methylhex-5-enyl)piperidine?
The canonical SMILES for 2-(2-cyclopentyl-2-methylhex-5-enyl)piperidine is C=CCCC(C)(CC1CCCCN1)C1CCCC1.
What is the InChIKey of 2-(2-cyclopentyl-2-methylhex-5-enyl)piperidine?
The InChIKey is OWNNMQHVLYEPTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H31N/c1-3-4-12-17(2,15-9-5-6-10-15)14-16-11-7-8-13-18-16/h3,15-16,18H,1,4-14H2,2H3.
What are the key properties of 2-(2-cyclopentyl-2-methylhex-5-enyl)piperidine?
2-(2-cyclopentyl-2-methylhex-5-enyl)piperidine has a molecular weight of 249.44 g/mol, XLogP of 4.68, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-cyclopentyl-2-methylhex-5-enyl)piperidine is sourced from PubChem (CID 58418700), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).