1-pyrrolidin-1-ylazetidin-2-one

C7H12N2O — CID 91052946

IUPAC1-pyrrolidin-1-ylazetidin-2-one
SMILESO=C1CCN1N1CCCC1
InChIInChI=1S/C7H12N2O/c10-7-3-6-9(7)8-4-1-2-5-8/h1-6H2
InChIKeyGBHYDGAWEZGGEX-UHFFFAOYSA-N
MW140.19 g/mol
LogP0.23
Rot. Bonds1

About 1-pyrrolidin-1-ylazetidin-2-one

1-pyrrolidin-1-ylazetidin-2-one (PubChem CID 91052946) has the molecular formula C7H12N2O and a molecular weight of 140.19 g/mol. Its IUPAC name is 1-pyrrolidin-1-ylazetidin-2-one.

Molecular Properties

Compound Name1-pyrrolidin-1-ylazetidin-2-one
PubChem CID91052946
Molecular FormulaC7H12N2O
Molecular Weight140.19 g/mol
Exact Mass140.09
IUPAC Name1-pyrrolidin-1-ylazetidin-2-one
SMILESO=C1CCN1N1CCCC1
InChIInChI=1S/C7H12N2O/c10-7-3-6-9(7)8-4-1-2-5-8/h1-6H2
InChIKeyGBHYDGAWEZGGEX-UHFFFAOYSA-N
XLogP0.23
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.19
LogP ≤ 50.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 1-pyrrolidin-1-ylazetidin-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 1-pyrrolidin-1-ylazetidin-2-one?
The IUPAC name of 1-pyrrolidin-1-ylazetidin-2-one (CID 91052946) is 1-pyrrolidin-1-ylazetidin-2-one.
What is the SMILES notation for 1-pyrrolidin-1-ylazetidin-2-one?
The canonical SMILES for 1-pyrrolidin-1-ylazetidin-2-one is O=C1CCN1N1CCCC1.
What is the InChIKey of 1-pyrrolidin-1-ylazetidin-2-one?
The InChIKey is GBHYDGAWEZGGEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12N2O/c10-7-3-6-9(7)8-4-1-2-5-8/h1-6H2.
What are the key properties of 1-pyrrolidin-1-ylazetidin-2-one?
1-pyrrolidin-1-ylazetidin-2-one has a molecular weight of 140.19 g/mol, XLogP of 0.23, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-pyrrolidin-1-ylazetidin-2-one is sourced from PubChem (CID 91052946), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).