4-[(E)-2-(4-cyclohexylcyclohexyl)ethenyl]piperidine

C19H33N — CID 167240428

IUPAC4-[(E)-2-(4-cyclohexylcyclohexyl)ethenyl]piperidine
SMILESC(=C/C1CCC(C2CCCCC2)CC1)\C1CCNCC1
InChIInChI=1S/C19H33N/c1-2-4-18(5-3-1)19-10-8-16(9-11-19)6-7-17-12-14-20-15-13-17/h6-7,16-20H,1-5,8-15H2/b7-6+
InChIKeyRRDQIPAQRNMECG-VOTSOKGWSA-N
MW275.48 g/mol
LogP4.93
Rot. Bonds3

About 4-[(E)-2-(4-cyclohexylcyclohexyl)ethenyl]piperidine

4-[(E)-2-(4-cyclohexylcyclohexyl)ethenyl]piperidine (PubChem CID 167240428) has the molecular formula C19H33N and a molecular weight of 275.48 g/mol. Its IUPAC name is 4-[(E)-2-(4-cyclohexylcyclohexyl)ethenyl]piperidine.

Molecular Properties

Compound Name4-[(E)-2-(4-cyclohexylcyclohexyl)ethenyl]piperidine
PubChem CID167240428
Molecular FormulaC19H33N
Molecular Weight275.48 g/mol
Exact Mass275.26
IUPAC Name4-[(E)-2-(4-cyclohexylcyclohexyl)ethenyl]piperidine
SMILESC(=C/C1CCC(C2CCCCC2)CC1)\C1CCNCC1
InChIInChI=1S/C19H33N/c1-2-4-18(5-3-1)19-10-8-16(9-11-19)6-7-17-12-14-20-15-13-17/h6-7,16-20H,1-5,8-15H2/b7-6+
InChIKeyRRDQIPAQRNMECG-VOTSOKGWSA-N
XLogP4.93
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.48
LogP ≤ 54.93
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

Hexadiline
CID 219119
1,4-Cyclohexanebis(methylamine), N,N'-bis(3-cyclohexenylmethyl)-, dihydrochloride
CID 102619
Neopetrocyclamine B
CID 122177441
(1R,2E,19S,20R,25S)-13,17-diazatricyclo[17.8.0.020,25]heptacosa-2,9,26-triene
CID 163191573
2-cyclohexyl-N-[[4-[(2-cyclohexylethylamino)methyl]cyclohex-3-en-1-yl]methyl]ethanamine
CID 102798
6-cyclohexyl-4-(4-fluorocyclohexyl)-2-propan-2-yl-3-[(E)-prop-1-enyl]piperidine
CID 140422236
4-(4-Fluoro-5-methylcyclohex-2-en-1-yl)piperidine
CID 163500154
N-(cyclohex-2-en-1-ylmethyl)-1-[4-[(cyclohex-2-en-1-ylmethylamino)methyl]cyclohexyl]methanamine
CID 102620
3-[4-[(E)-2-[4-(1-fluoro-4-methylpentyl)cyclohexyl]ethenyl]cyclohexyl]pyrrolidine
CID 144328772
3-[4-[(E)-2-[4-(2-fluoropropyl)cyclohexyl]ethenyl]cyclohexyl]pyrrolidine
CID 144328822
N'-[3-[1,5-bis(2-bicyclo[2.2.2]oct-5-enyl)pentan-3-ylamino]propyl]propane-1,3-diamine
CID 20319870
4-(Cyclohex-3-en-1-yl)piperidine
CID 20488517

Frequently Asked Questions

What is the IUPAC name of 4-[(E)-2-(4-cyclohexylcyclohexyl)ethenyl]piperidine?
The IUPAC name of 4-[(E)-2-(4-cyclohexylcyclohexyl)ethenyl]piperidine (CID 167240428) is 4-[(E)-2-(4-cyclohexylcyclohexyl)ethenyl]piperidine.
What is the SMILES notation for 4-[(E)-2-(4-cyclohexylcyclohexyl)ethenyl]piperidine?
The canonical SMILES for 4-[(E)-2-(4-cyclohexylcyclohexyl)ethenyl]piperidine is C(=C/C1CCC(C2CCCCC2)CC1)\C1CCNCC1.
What is the InChIKey of 4-[(E)-2-(4-cyclohexylcyclohexyl)ethenyl]piperidine?
The InChIKey is RRDQIPAQRNMECG-VOTSOKGWSA-N. The full InChI is InChI=1S/C19H33N/c1-2-4-18(5-3-1)19-10-8-16(9-11-19)6-7-17-12-14-20-15-13-17/h6-7,16-20H,1-5,8-15H2/b7-6+.
What are the key properties of 4-[(E)-2-(4-cyclohexylcyclohexyl)ethenyl]piperidine?
4-[(E)-2-(4-cyclohexylcyclohexyl)ethenyl]piperidine has a molecular weight of 275.48 g/mol, XLogP of 4.93, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(E)-2-(4-cyclohexylcyclohexyl)ethenyl]piperidine is sourced from PubChem (CID 167240428), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).