1-ethoxy-2-prop-2-enoxycyclohexane

C11H20O2 — CID 122580232

IUPAC1-ethoxy-2-prop-2-enoxycyclohexane
SMILESC=CCOC1CCCCC1OCC
InChIInChI=1S/C11H20O2/c1-3-9-13-11-8-6-5-7-10(11)12-4-2/h3,10-11H,1,4-9H2,2H3
InChIKeyDPEQIBDRBISWTF-UHFFFAOYSA-N
MW184.28 g/mol
LogP2.54
Rot. Bonds5

About 1-ethoxy-2-prop-2-enoxycyclohexane

1-ethoxy-2-prop-2-enoxycyclohexane (PubChem CID 122580232) has the molecular formula C11H20O2 and a molecular weight of 184.28 g/mol. Its IUPAC name is 1-ethoxy-2-prop-2-enoxycyclohexane.

Molecular Properties

Compound Name1-ethoxy-2-prop-2-enoxycyclohexane
PubChem CID122580232
Molecular FormulaC11H20O2
Molecular Weight184.28 g/mol
Exact Mass184.15
IUPAC Name1-ethoxy-2-prop-2-enoxycyclohexane
SMILESC=CCOC1CCCCC1OCC
InChIInChI=1S/C11H20O2/c1-3-9-13-11-8-6-5-7-10(11)12-4-2/h3,10-11H,1,4-9H2,2H3
InChIKeyDPEQIBDRBISWTF-UHFFFAOYSA-N
XLogP2.54
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.28
LogP ≤ 52.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 1-ethoxy-2-prop-2-enoxycyclohexane 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 1-ethoxy-2-prop-2-enoxycyclohexane?
The IUPAC name of 1-ethoxy-2-prop-2-enoxycyclohexane (CID 122580232) is 1-ethoxy-2-prop-2-enoxycyclohexane.
What is the SMILES notation for 1-ethoxy-2-prop-2-enoxycyclohexane?
The canonical SMILES for 1-ethoxy-2-prop-2-enoxycyclohexane is C=CCOC1CCCCC1OCC.
What is the InChIKey of 1-ethoxy-2-prop-2-enoxycyclohexane?
The InChIKey is DPEQIBDRBISWTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20O2/c1-3-9-13-11-8-6-5-7-10(11)12-4-2/h3,10-11H,1,4-9H2,2H3.
What are the key properties of 1-ethoxy-2-prop-2-enoxycyclohexane?
1-ethoxy-2-prop-2-enoxycyclohexane has a molecular weight of 184.28 g/mol, XLogP of 2.54, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethoxy-2-prop-2-enoxycyclohexane is sourced from PubChem (CID 122580232), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).