cyclopent-3-en-1-ol;ethane

C7H14O — CID 169236047

IUPACcyclopent-3-en-1-ol;ethane
SMILESCC.OC1CC=CC1
InChIInChI=1S/C5H8O.C2H6/c6-5-3-1-2-4-5;1-2/h1-2,5-6H,3-4H2;1-2H3
InChIKeyCJIQUCHKDZQODP-UHFFFAOYSA-N
MW114.19 g/mol
LogP1.72
Rot. Bonds

About cyclopent-3-en-1-ol;ethane

cyclopent-3-en-1-ol;ethane (PubChem CID 169236047) has the molecular formula C7H14O and a molecular weight of 114.19 g/mol. Its IUPAC name is cyclopent-3-en-1-ol;ethane.

Molecular Properties

Compound Namecyclopent-3-en-1-ol;ethane
PubChem CID169236047
Molecular FormulaC7H14O
Molecular Weight114.19 g/mol
Exact Mass114.10
IUPAC Namecyclopent-3-en-1-ol;ethane
SMILESCC.OC1CC=CC1
InChIInChI=1S/C5H8O.C2H6/c6-5-3-1-2-4-5;1-2/h1-2,5-6H,3-4H2;1-2H3
InChIKeyCJIQUCHKDZQODP-UHFFFAOYSA-N
XLogP1.72
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500114.19
LogP ≤ 51.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze cyclopent-3-en-1-ol;ethane 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 cyclopent-3-en-1-ol;ethane?
The IUPAC name of cyclopent-3-en-1-ol;ethane (CID 169236047) is cyclopent-3-en-1-ol;ethane.
What is the SMILES notation for cyclopent-3-en-1-ol;ethane?
The canonical SMILES for cyclopent-3-en-1-ol;ethane is CC.OC1CC=CC1.
What is the InChIKey of cyclopent-3-en-1-ol;ethane?
The InChIKey is CJIQUCHKDZQODP-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H8O.C2H6/c6-5-3-1-2-4-5;1-2/h1-2,5-6H,3-4H2;1-2H3.
What are the key properties of cyclopent-3-en-1-ol;ethane?
cyclopent-3-en-1-ol;ethane has a molecular weight of 114.19 g/mol, XLogP of 1.72, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopent-3-en-1-ol;ethane is sourced from PubChem (CID 169236047), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).