2-ethenyl-3-(5-ethenylcyclopent-2-en-1-yl)oxirane

C11H14O — CID 14580560

IUPAC2-ethenyl-3-(5-ethenylcyclopent-2-en-1-yl)oxirane
SMILESC=CC1CC=CC1C1OC1C=C
InChIInChI=1S/C11H14O/c1-3-8-6-5-7-9(8)11-10(4-2)12-11/h3-5,7-11H,1-2,6H2
InChIKeyUXWZDKBRXXYPDJ-UHFFFAOYSA-N
MW162.23 g/mol
LogP2.32
Rot. Bonds3

About 2-ethenyl-3-(5-ethenylcyclopent-2-en-1-yl)oxirane

2-ethenyl-3-(5-ethenylcyclopent-2-en-1-yl)oxirane (PubChem CID 14580560) has the molecular formula C11H14O and a molecular weight of 162.23 g/mol. Its IUPAC name is 2-ethenyl-3-(5-ethenylcyclopent-2-en-1-yl)oxirane.

Molecular Properties

Compound Name2-ethenyl-3-(5-ethenylcyclopent-2-en-1-yl)oxirane
PubChem CID14580560
Molecular FormulaC11H14O
Molecular Weight162.23 g/mol
Exact Mass162.10
IUPAC Name2-ethenyl-3-(5-ethenylcyclopent-2-en-1-yl)oxirane
SMILESC=CC1CC=CC1C1OC1C=C
InChIInChI=1S/C11H14O/c1-3-8-6-5-7-9(8)11-10(4-2)12-11/h3-5,7-11H,1-2,6H2
InChIKeyUXWZDKBRXXYPDJ-UHFFFAOYSA-N
XLogP2.32
TPSA12.53 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.23
LogP ≤ 52.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-ethenyl-3-(5-ethenylcyclopent-2-en-1-yl)oxirane?
The IUPAC name of 2-ethenyl-3-(5-ethenylcyclopent-2-en-1-yl)oxirane (CID 14580560) is 2-ethenyl-3-(5-ethenylcyclopent-2-en-1-yl)oxirane.
What is the SMILES notation for 2-ethenyl-3-(5-ethenylcyclopent-2-en-1-yl)oxirane?
The canonical SMILES for 2-ethenyl-3-(5-ethenylcyclopent-2-en-1-yl)oxirane is C=CC1CC=CC1C1OC1C=C.
What is the InChIKey of 2-ethenyl-3-(5-ethenylcyclopent-2-en-1-yl)oxirane?
The InChIKey is UXWZDKBRXXYPDJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14O/c1-3-8-6-5-7-9(8)11-10(4-2)12-11/h3-5,7-11H,1-2,6H2.
What are the key properties of 2-ethenyl-3-(5-ethenylcyclopent-2-en-1-yl)oxirane?
2-ethenyl-3-(5-ethenylcyclopent-2-en-1-yl)oxirane has a molecular weight of 162.23 g/mol, XLogP of 2.32, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethenyl-3-(5-ethenylcyclopent-2-en-1-yl)oxirane is sourced from PubChem (CID 14580560), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).