[(E)-pent-2-enoxy]cyclohexane

C11H20O — CID 135063528

IUPAC[(E)-pent-2-enoxy]cyclohexane
SMILESCC/C=C/COC1CCCCC1
InChIInChI=1S/C11H20O/c1-2-3-7-10-12-11-8-5-4-6-9-11/h3,7,11H,2,4-6,8-10H2,1H3/b7-3+
InChIKeyDRXRSGCXXQAZGZ-XVNBXDOJSA-N
MW168.28 g/mol
LogP3.30
Rot. Bonds4

About [(E)-pent-2-enoxy]cyclohexane

[(E)-pent-2-enoxy]cyclohexane (PubChem CID 135063528) has the molecular formula C11H20O and a molecular weight of 168.28 g/mol. Its IUPAC name is [(E)-pent-2-enoxy]cyclohexane.

Molecular Properties

Compound Name[(E)-pent-2-enoxy]cyclohexane
PubChem CID135063528
Molecular FormulaC11H20O
Molecular Weight168.28 g/mol
Exact Mass168.15
IUPAC Name[(E)-pent-2-enoxy]cyclohexane
SMILESCC/C=C/COC1CCCCC1
InChIInChI=1S/C11H20O/c1-2-3-7-10-12-11-8-5-4-6-9-11/h3,7,11H,2,4-6,8-10H2,1H3/b7-3+
InChIKeyDRXRSGCXXQAZGZ-XVNBXDOJSA-N
XLogP3.30
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.28
LogP ≤ 53.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze [(E)-pent-2-enoxy]cyclohexane 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)-pent-2-enoxy]cyclohexane?
The IUPAC name of [(E)-pent-2-enoxy]cyclohexane (CID 135063528) is [(E)-pent-2-enoxy]cyclohexane.
What is the SMILES notation for [(E)-pent-2-enoxy]cyclohexane?
The canonical SMILES for [(E)-pent-2-enoxy]cyclohexane is CC/C=C/COC1CCCCC1.
What is the InChIKey of [(E)-pent-2-enoxy]cyclohexane?
The InChIKey is DRXRSGCXXQAZGZ-XVNBXDOJSA-N. The full InChI is InChI=1S/C11H20O/c1-2-3-7-10-12-11-8-5-4-6-9-11/h3,7,11H,2,4-6,8-10H2,1H3/b7-3+.
What are the key properties of [(E)-pent-2-enoxy]cyclohexane?
[(E)-pent-2-enoxy]cyclohexane has a molecular weight of 168.28 g/mol, XLogP of 3.30, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [(E)-pent-2-enoxy]cyclohexane is sourced from PubChem (CID 135063528), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).