3-cyclopropylpyrrolidin-2-one

C7H11NO — CID 18442678

IUPAC3-cyclopropylpyrrolidin-2-one
SMILESO=C1NCCC1C1CC1
InChIInChI=1S/C7H11NO/c9-7-6(3-4-8-7)5-1-2-5/h5-6H,1-4H2,(H,8,9)
InChIKeyYJHIWTDVOURJEK-UHFFFAOYSA-N
MW125.17 g/mol
LogP0.53
Rot. Bonds1

About 3-cyclopropylpyrrolidin-2-one

3-cyclopropylpyrrolidin-2-one (PubChem CID 18442678) has the molecular formula C7H11NO and a molecular weight of 125.17 g/mol. Its IUPAC name is 3-cyclopropylpyrrolidin-2-one.

Molecular Properties

Compound Name3-cyclopropylpyrrolidin-2-one
PubChem CID18442678
Molecular FormulaC7H11NO
Molecular Weight125.17 g/mol
Exact Mass125.08
IUPAC Name3-cyclopropylpyrrolidin-2-one
SMILESO=C1NCCC1C1CC1
InChIInChI=1S/C7H11NO/c9-7-6(3-4-8-7)5-1-2-5/h5-6H,1-4H2,(H,8,9)
InChIKeyYJHIWTDVOURJEK-UHFFFAOYSA-N
XLogP0.53
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500125.17
LogP ≤ 50.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 3-cyclopropylpyrrolidin-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 3-cyclopropylpyrrolidin-2-one?
The IUPAC name of 3-cyclopropylpyrrolidin-2-one (CID 18442678) is 3-cyclopropylpyrrolidin-2-one.
What is the SMILES notation for 3-cyclopropylpyrrolidin-2-one?
The canonical SMILES for 3-cyclopropylpyrrolidin-2-one is O=C1NCCC1C1CC1.
What is the InChIKey of 3-cyclopropylpyrrolidin-2-one?
The InChIKey is YJHIWTDVOURJEK-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11NO/c9-7-6(3-4-8-7)5-1-2-5/h5-6H,1-4H2,(H,8,9).
What are the key properties of 3-cyclopropylpyrrolidin-2-one?
3-cyclopropylpyrrolidin-2-one has a molecular weight of 125.17 g/mol, XLogP of 0.53, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclopropylpyrrolidin-2-one is sourced from PubChem (CID 18442678), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).