1-ethenyl-4-ethylidenecyclopentene

C9H12 — CID 91320821

IUPAC1-ethenyl-4-ethylidenecyclopentene
SMILESC=CC1=CCC(=CC)C1
InChIInChI=1S/C9H12/c1-3-8-5-6-9(4-2)7-8/h3-5H,1,6-7H2,2H3
InChIKeyGZXSZUGWDZDJDI-UHFFFAOYSA-N
MW120.19 g/mol
LogP2.84
Rot. Bonds1

About 1-ethenyl-4-ethylidenecyclopentene

1-ethenyl-4-ethylidenecyclopentene (PubChem CID 91320821) has the molecular formula C9H12 and a molecular weight of 120.19 g/mol. Its IUPAC name is 1-ethenyl-4-ethylidenecyclopentene.

Molecular Properties

Compound Name1-ethenyl-4-ethylidenecyclopentene
PubChem CID91320821
Molecular FormulaC9H12
Molecular Weight120.19 g/mol
Exact Mass120.09
IUPAC Name1-ethenyl-4-ethylidenecyclopentene
SMILESC=CC1=CCC(=CC)C1
InChIInChI=1S/C9H12/c1-3-8-5-6-9(4-2)7-8/h3-5H,1,6-7H2,2H3
InChIKeyGZXSZUGWDZDJDI-UHFFFAOYSA-N
XLogP2.84
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500120.19
LogP ≤ 52.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

ethane;(4Z)-4-(fluoromethylidene)-1-[(Z)-prop-1-enyl]cyclopentene
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4-ethenyl-2-methyl-3,6-dihydro-2H-thiopyran
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2,6-bis(ethenyl)-4,8-dimethyl-1,5-dihydro-s-indacene
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1-ethenyl-5-methylcyclohexene
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1-ethenylcyclooctene
CID 54012738
2-ethenyl-4,7-dimethyl-1H-indene
CID 145268234
3-ethenyl-5-methylidenecyclopent-2-en-1-one
CID 144754943
(3E)-1-ethenyl-3-ethylidenecyclopentane
CID 155632567
(5Z)-5-ethylidene-1-methylcycloheptene
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Frequently Asked Questions

What is the IUPAC name of 1-ethenyl-4-ethylidenecyclopentene?
The IUPAC name of 1-ethenyl-4-ethylidenecyclopentene (CID 91320821) is 1-ethenyl-4-ethylidenecyclopentene.
What is the SMILES notation for 1-ethenyl-4-ethylidenecyclopentene?
The canonical SMILES for 1-ethenyl-4-ethylidenecyclopentene is C=CC1=CCC(=CC)C1.
What is the InChIKey of 1-ethenyl-4-ethylidenecyclopentene?
The InChIKey is GZXSZUGWDZDJDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12/c1-3-8-5-6-9(4-2)7-8/h3-5H,1,6-7H2,2H3.
What are the key properties of 1-ethenyl-4-ethylidenecyclopentene?
1-ethenyl-4-ethylidenecyclopentene has a molecular weight of 120.19 g/mol, XLogP of 2.84, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethenyl-4-ethylidenecyclopentene is sourced from PubChem (CID 91320821), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).