2-ethoxy-2-pent-4-enyl-1,3-dioxolane

C10H18O3 — CID 154719587

IUPAC2-ethoxy-2-pent-4-enyl-1,3-dioxolane
SMILESC=CCCCC1(OCC)OCCO1
InChIInChI=1S/C10H18O3/c1-3-5-6-7-10(11-4-2)12-8-9-13-10/h3H,1,4-9H2,2H3
InChIKeyFNYOYPCVZRIIJL-UHFFFAOYSA-N
MW186.25 g/mol
LogP2.08
Rot. Bonds6

About 2-ethoxy-2-pent-4-enyl-1,3-dioxolane

2-ethoxy-2-pent-4-enyl-1,3-dioxolane (PubChem CID 154719587) has the molecular formula C10H18O3 and a molecular weight of 186.25 g/mol. Its IUPAC name is 2-ethoxy-2-pent-4-enyl-1,3-dioxolane.

Molecular Properties

Compound Name2-ethoxy-2-pent-4-enyl-1,3-dioxolane
PubChem CID154719587
Molecular FormulaC10H18O3
Molecular Weight186.25 g/mol
Exact Mass186.13
IUPAC Name2-ethoxy-2-pent-4-enyl-1,3-dioxolane
SMILESC=CCCCC1(OCC)OCCO1
InChIInChI=1S/C10H18O3/c1-3-5-6-7-10(11-4-2)12-8-9-13-10/h3H,1,4-9H2,2H3
InChIKeyFNYOYPCVZRIIJL-UHFFFAOYSA-N
XLogP2.08
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.25
LogP ≤ 52.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 2-ethoxy-2-pent-4-enyl-1,3-dioxolane 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 2-ethoxy-2-pent-4-enyl-1,3-dioxolane?
The IUPAC name of 2-ethoxy-2-pent-4-enyl-1,3-dioxolane (CID 154719587) is 2-ethoxy-2-pent-4-enyl-1,3-dioxolane.
What is the SMILES notation for 2-ethoxy-2-pent-4-enyl-1,3-dioxolane?
The canonical SMILES for 2-ethoxy-2-pent-4-enyl-1,3-dioxolane is C=CCCCC1(OCC)OCCO1.
What is the InChIKey of 2-ethoxy-2-pent-4-enyl-1,3-dioxolane?
The InChIKey is FNYOYPCVZRIIJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18O3/c1-3-5-6-7-10(11-4-2)12-8-9-13-10/h3H,1,4-9H2,2H3.
What are the key properties of 2-ethoxy-2-pent-4-enyl-1,3-dioxolane?
2-ethoxy-2-pent-4-enyl-1,3-dioxolane has a molecular weight of 186.25 g/mol, XLogP of 2.08, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-2-pent-4-enyl-1,3-dioxolane is sourced from PubChem (CID 154719587), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).