[(2E)-2-hexylidenecyclopentyl]benzene

C17H24 — CID 15354301

IUPAC[(2E)-2-hexylidenecyclopentyl]benzene
SMILESCCCCC/C=C1\CCCC1c1ccccc1
InChIInChI=1S/C17H24/c1-2-3-4-6-10-16-13-9-14-17(16)15-11-7-5-8-12-15/h5,7-8,10-12,17H,2-4,6,9,13-14H2,1H3/b16-10+
InChIKeyNXKZHGRUZAEQDT-MHWRWJLKSA-N
MW228.38 g/mol
LogP5.46
Rot. Bonds5

About [(2E)-2-hexylidenecyclopentyl]benzene

[(2E)-2-hexylidenecyclopentyl]benzene (PubChem CID 15354301) has the molecular formula C17H24 and a molecular weight of 228.38 g/mol. Its IUPAC name is [(2E)-2-hexylidenecyclopentyl]benzene.

Molecular Properties

Compound Name[(2E)-2-hexylidenecyclopentyl]benzene
PubChem CID15354301
Molecular FormulaC17H24
Molecular Weight228.38 g/mol
Exact Mass228.19
IUPAC Name[(2E)-2-hexylidenecyclopentyl]benzene
SMILESCCCCC/C=C1\CCCC1c1ccccc1
InChIInChI=1S/C17H24/c1-2-3-4-6-10-16-13-9-14-17(16)15-11-7-5-8-12-15/h5,7-8,10-12,17H,2-4,6,9,13-14H2,1H3/b16-10+
InChIKeyNXKZHGRUZAEQDT-MHWRWJLKSA-N
XLogP5.46
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500228.38
LogP ≤ 55.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

2-(2-hexylidenecyclopentyl)ethylbenzene
CID 71320397
1-methyl-2-nonylidenecyclopentane
CID 123463809
ethyl 2-(2-hydroxy-6-tetradecylidenecyclohexyl)sulfanylacetate
CID 70350422
butyl-methyl-bis(4-phenyl-2,3,4,5,6,7-hexahydro-1H-inden-1-yl)silane
CID 21338125
(E)-N-[(2S,5S)-2,5-diphenylpyrrolidin-1-yl]hexan-1-imine
CID 135077796
(3-hexylcyclohex-2-en-1-yl)benzene
CID 100958783
[(E)-dec-1-enyl]-phenyliodanium
CID 10906117
1-octadecan-4-ylsulfanyl-3-phenylazepane-2,7-dione
CID 21260078
hexylidenecyclobutane
CID 86127710
9-hexylidenefluorene
CID 58121399
(2R,6S)-1-pentyl-2,6-diphenylpiperidine
CID 132552857
3-hexadecylidenecyclohexan-1-ol
CID 91228547

Frequently Asked Questions

What is the IUPAC name of [(2E)-2-hexylidenecyclopentyl]benzene?
The IUPAC name of [(2E)-2-hexylidenecyclopentyl]benzene (CID 15354301) is [(2E)-2-hexylidenecyclopentyl]benzene.
What is the SMILES notation for [(2E)-2-hexylidenecyclopentyl]benzene?
The canonical SMILES for [(2E)-2-hexylidenecyclopentyl]benzene is CCCCC/C=C1\CCCC1c1ccccc1.
What is the InChIKey of [(2E)-2-hexylidenecyclopentyl]benzene?
The InChIKey is NXKZHGRUZAEQDT-MHWRWJLKSA-N. The full InChI is InChI=1S/C17H24/c1-2-3-4-6-10-16-13-9-14-17(16)15-11-7-5-8-12-15/h5,7-8,10-12,17H,2-4,6,9,13-14H2,1H3/b16-10+.
What are the key properties of [(2E)-2-hexylidenecyclopentyl]benzene?
[(2E)-2-hexylidenecyclopentyl]benzene has a molecular weight of 228.38 g/mol, XLogP of 5.46, 5 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for [(2E)-2-hexylidenecyclopentyl]benzene is sourced from PubChem (CID 15354301), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).