1-ethoxy-2-prop-2-enoxycyclopentane

C10H18O2 — CID 122580226

IUPAC1-ethoxy-2-prop-2-enoxycyclopentane
SMILESC=CCOC1CCCC1OCC
InChIInChI=1S/C10H18O2/c1-3-8-12-10-7-5-6-9(10)11-4-2/h3,9-10H,1,4-8H2,2H3
InChIKeyNAVHVQGADUZGLL-UHFFFAOYSA-N
MW170.25 g/mol
LogP2.15
Rot. Bonds5

About 1-ethoxy-2-prop-2-enoxycyclopentane

1-ethoxy-2-prop-2-enoxycyclopentane (PubChem CID 122580226) has the molecular formula C10H18O2 and a molecular weight of 170.25 g/mol. Its IUPAC name is 1-ethoxy-2-prop-2-enoxycyclopentane.

Molecular Properties

Compound Name1-ethoxy-2-prop-2-enoxycyclopentane
PubChem CID122580226
Molecular FormulaC10H18O2
Molecular Weight170.25 g/mol
Exact Mass170.13
IUPAC Name1-ethoxy-2-prop-2-enoxycyclopentane
SMILESC=CCOC1CCCC1OCC
InChIInChI=1S/C10H18O2/c1-3-8-12-10-7-5-6-9(10)11-4-2/h3,9-10H,1,4-8H2,2H3
InChIKeyNAVHVQGADUZGLL-UHFFFAOYSA-N
XLogP2.15
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.25
LogP ≤ 52.15
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-enoxycyclopentane 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-enoxycyclopentane?
The IUPAC name of 1-ethoxy-2-prop-2-enoxycyclopentane (CID 122580226) is 1-ethoxy-2-prop-2-enoxycyclopentane.
What is the SMILES notation for 1-ethoxy-2-prop-2-enoxycyclopentane?
The canonical SMILES for 1-ethoxy-2-prop-2-enoxycyclopentane is C=CCOC1CCCC1OCC.
What is the InChIKey of 1-ethoxy-2-prop-2-enoxycyclopentane?
The InChIKey is NAVHVQGADUZGLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18O2/c1-3-8-12-10-7-5-6-9(10)11-4-2/h3,9-10H,1,4-8H2,2H3.
What are the key properties of 1-ethoxy-2-prop-2-enoxycyclopentane?
1-ethoxy-2-prop-2-enoxycyclopentane has a molecular weight of 170.25 g/mol, XLogP of 2.15, 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-enoxycyclopentane is sourced from PubChem (CID 122580226), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).