4-cyclobutylpyrrolidin-2-one

C8H13NO — CID 22990583

IUPAC4-cyclobutylpyrrolidin-2-one
SMILESO=C1CC(C2CCC2)CN1
InChIInChI=1S/C8H13NO/c10-8-4-7(5-9-8)6-2-1-3-6/h6-7H,1-5H2,(H,9,10)
InChIKeyCVRJEQBETQXNIG-UHFFFAOYSA-N
MW139.20 g/mol
LogP0.92
Rot. Bonds1

About 4-cyclobutylpyrrolidin-2-one

4-cyclobutylpyrrolidin-2-one (PubChem CID 22990583) has the molecular formula C8H13NO and a molecular weight of 139.20 g/mol. Its IUPAC name is 4-cyclobutylpyrrolidin-2-one.

Molecular Properties

Compound Name4-cyclobutylpyrrolidin-2-one
PubChem CID22990583
Molecular FormulaC8H13NO
Molecular Weight139.20 g/mol
Exact Mass139.10
IUPAC Name4-cyclobutylpyrrolidin-2-one
SMILESO=C1CC(C2CCC2)CN1
InChIInChI=1S/C8H13NO/c10-8-4-7(5-9-8)6-2-1-3-6/h6-7H,1-5H2,(H,9,10)
InChIKeyCVRJEQBETQXNIG-UHFFFAOYSA-N
XLogP0.92
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500139.20
LogP ≤ 50.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 4-cyclobutylpyrrolidin-2-one 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 4-cyclobutylpyrrolidin-2-one?
The IUPAC name of 4-cyclobutylpyrrolidin-2-one (CID 22990583) is 4-cyclobutylpyrrolidin-2-one.
What is the SMILES notation for 4-cyclobutylpyrrolidin-2-one?
The canonical SMILES for 4-cyclobutylpyrrolidin-2-one is O=C1CC(C2CCC2)CN1.
What is the InChIKey of 4-cyclobutylpyrrolidin-2-one?
The InChIKey is CVRJEQBETQXNIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13NO/c10-8-4-7(5-9-8)6-2-1-3-6/h6-7H,1-5H2,(H,9,10).
What are the key properties of 4-cyclobutylpyrrolidin-2-one?
4-cyclobutylpyrrolidin-2-one has a molecular weight of 139.20 g/mol, XLogP of 0.92, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclobutylpyrrolidin-2-one is sourced from PubChem (CID 22990583), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).