cyclopent-2-en-1-one;ethoxyethane

C9H16O2 — CID 23346686

IUPACcyclopent-2-en-1-one;ethoxyethane
SMILESCCOCC.O=C1C=CCC1
InChIInChI=1S/C5H6O.C4H10O/c6-5-3-1-2-4-5;1-3-5-4-2/h1,3H,2,4H2;3-4H2,1-2H3
InChIKeyNUNAOMHZYIJMHN-UHFFFAOYSA-N
MW156.22 g/mol
LogP1.95
Rot. Bonds2

About cyclopent-2-en-1-one;ethoxyethane

cyclopent-2-en-1-one;ethoxyethane (PubChem CID 23346686) has the molecular formula C9H16O2 and a molecular weight of 156.22 g/mol. Its IUPAC name is cyclopent-2-en-1-one;ethoxyethane.

Molecular Properties

Compound Namecyclopent-2-en-1-one;ethoxyethane
PubChem CID23346686
Molecular FormulaC9H16O2
Molecular Weight156.22 g/mol
Exact Mass156.12
IUPAC Namecyclopent-2-en-1-one;ethoxyethane
SMILESCCOCC.O=C1C=CCC1
InChIInChI=1S/C5H6O.C4H10O/c6-5-3-1-2-4-5;1-3-5-4-2/h1,3H,2,4H2;3-4H2,1-2H3
InChIKeyNUNAOMHZYIJMHN-UHFFFAOYSA-N
XLogP1.95
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.22
LogP ≤ 51.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze cyclopent-2-en-1-one;ethoxyethane 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-2-en-1-one;ethoxyethane?
The IUPAC name of cyclopent-2-en-1-one;ethoxyethane (CID 23346686) is cyclopent-2-en-1-one;ethoxyethane.
What is the SMILES notation for cyclopent-2-en-1-one;ethoxyethane?
The canonical SMILES for cyclopent-2-en-1-one;ethoxyethane is CCOCC.O=C1C=CCC1.
What is the InChIKey of cyclopent-2-en-1-one;ethoxyethane?
The InChIKey is NUNAOMHZYIJMHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H6O.C4H10O/c6-5-3-1-2-4-5;1-3-5-4-2/h1,3H,2,4H2;3-4H2,1-2H3.
What are the key properties of cyclopent-2-en-1-one;ethoxyethane?
cyclopent-2-en-1-one;ethoxyethane has a molecular weight of 156.22 g/mol, XLogP of 1.95, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopent-2-en-1-one;ethoxyethane is sourced from PubChem (CID 23346686), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).