[(E)-2-ethoxyethenyl]cyclopentane

C9H16O — CID 13163943

IUPAC[(E)-2-ethoxyethenyl]cyclopentane
SMILESCCO/C=C/C1CCCC1
InChIInChI=1S/C9H16O/c1-2-10-8-7-9-5-3-4-6-9/h7-9H,2-6H2,1H3/b8-7+
InChIKeyVECBSUFLKORCRY-BQYQJAHWSA-N
MW140.23 g/mol
LogP2.73
Rot. Bonds3

About [(E)-2-ethoxyethenyl]cyclopentane

[(E)-2-ethoxyethenyl]cyclopentane (PubChem CID 13163943) has the molecular formula C9H16O and a molecular weight of 140.23 g/mol. Its IUPAC name is [(E)-2-ethoxyethenyl]cyclopentane.

Molecular Properties

Compound Name[(E)-2-ethoxyethenyl]cyclopentane
PubChem CID13163943
Molecular FormulaC9H16O
Molecular Weight140.23 g/mol
Exact Mass140.12
IUPAC Name[(E)-2-ethoxyethenyl]cyclopentane
SMILESCCO/C=C/C1CCCC1
InChIInChI=1S/C9H16O/c1-2-10-8-7-9-5-3-4-6-9/h7-9H,2-6H2,1H3/b8-7+
InChIKeyVECBSUFLKORCRY-BQYQJAHWSA-N
XLogP2.73
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.23
LogP ≤ 52.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}

Analyze [(E)-2-ethoxyethenyl]cyclopentane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of [(E)-2-ethoxyethenyl]cyclopentane?
The IUPAC name of [(E)-2-ethoxyethenyl]cyclopentane (CID 13163943) is [(E)-2-ethoxyethenyl]cyclopentane.
What is the SMILES notation for [(E)-2-ethoxyethenyl]cyclopentane?
The canonical SMILES for [(E)-2-ethoxyethenyl]cyclopentane is CCO/C=C/C1CCCC1.
What is the InChIKey of [(E)-2-ethoxyethenyl]cyclopentane?
The InChIKey is VECBSUFLKORCRY-BQYQJAHWSA-N. The full InChI is InChI=1S/C9H16O/c1-2-10-8-7-9-5-3-4-6-9/h7-9H,2-6H2,1H3/b8-7+.
What are the key properties of [(E)-2-ethoxyethenyl]cyclopentane?
[(E)-2-ethoxyethenyl]cyclopentane has a molecular weight of 140.23 g/mol, XLogP of 2.73, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [(E)-2-ethoxyethenyl]cyclopentane is sourced from PubChem (CID 13163943), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).