6-ethylidenespiro[2.5]octane

C10H16 — CID 152966238

IUPAC6-ethylidenespiro[2.5]octane
SMILESCC=C1CCC2(CC1)CC2
InChIInChI=1S/C10H16/c1-2-9-3-5-10(6-4-9)7-8-10/h2H,3-8H2,1H3
InChIKeyUROIZMSWCYXFMC-UHFFFAOYSA-N
MW136.24 g/mol
LogP3.29
Rot. Bonds

About 6-ethylidenespiro[2.5]octane

6-ethylidenespiro[2.5]octane (PubChem CID 152966238) has the molecular formula C10H16 and a molecular weight of 136.24 g/mol. Its IUPAC name is 6-ethylidenespiro[2.5]octane.

Molecular Properties

Compound Name6-ethylidenespiro[2.5]octane
PubChem CID152966238
Molecular FormulaC10H16
Molecular Weight136.24 g/mol
Exact Mass136.13
IUPAC Name6-ethylidenespiro[2.5]octane
SMILESCC=C1CCC2(CC1)CC2
InChIInChI=1S/C10H16/c1-2-9-3-5-10(6-4-9)7-8-10/h2H,3-8H2,1H3
InChIKeyUROIZMSWCYXFMC-UHFFFAOYSA-N
XLogP3.29
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500136.24
LogP ≤ 53.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

Analyze 6-ethylidenespiro[2.5]octane 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 6-ethylidenespiro[2.5]octane?
The IUPAC name of 6-ethylidenespiro[2.5]octane (CID 152966238) is 6-ethylidenespiro[2.5]octane.
What is the SMILES notation for 6-ethylidenespiro[2.5]octane?
The canonical SMILES for 6-ethylidenespiro[2.5]octane is CC=C1CCC2(CC1)CC2.
What is the InChIKey of 6-ethylidenespiro[2.5]octane?
The InChIKey is UROIZMSWCYXFMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16/c1-2-9-3-5-10(6-4-9)7-8-10/h2H,3-8H2,1H3.
What are the key properties of 6-ethylidenespiro[2.5]octane?
6-ethylidenespiro[2.5]octane has a molecular weight of 136.24 g/mol, XLogP of 3.29, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethylidenespiro[2.5]octane is sourced from PubChem (CID 152966238), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).