5-aminopyrrolidin-2-one

C4H8N2O — CID 12638466

IUPAC5-aminopyrrolidin-2-one
SMILESNC1CCC(=O)N1
InChIInChI=1S/C4H8N2O/c5-3-1-2-4(7)6-3/h3H,1-2,5H2,(H,6,7)
InChIKeyURKYFRSLKUNMFG-UHFFFAOYSA-N
MW100.12 g/mol
LogP-0.82
Rot. Bonds

About 5-aminopyrrolidin-2-one

5-aminopyrrolidin-2-one (PubChem CID 12638466) has the molecular formula C4H8N2O and a molecular weight of 100.12 g/mol. Its IUPAC name is 5-aminopyrrolidin-2-one.

Molecular Properties

Compound Name5-aminopyrrolidin-2-one
PubChem CID12638466
Molecular FormulaC4H8N2O
Molecular Weight100.12 g/mol
Exact Mass100.06
IUPAC Name5-aminopyrrolidin-2-one
SMILESNC1CCC(=O)N1
InChIInChI=1S/C4H8N2O/c5-3-1-2-4(7)6-3/h3H,1-2,5H2,(H,6,7)
InChIKeyURKYFRSLKUNMFG-UHFFFAOYSA-N
XLogP-0.82
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500100.12
LogP ≤ 5-0.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 5-aminopyrrolidin-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 5-aminopyrrolidin-2-one?
The IUPAC name of 5-aminopyrrolidin-2-one (CID 12638466) is 5-aminopyrrolidin-2-one.
What is the SMILES notation for 5-aminopyrrolidin-2-one?
The canonical SMILES for 5-aminopyrrolidin-2-one is NC1CCC(=O)N1.
What is the InChIKey of 5-aminopyrrolidin-2-one?
The InChIKey is URKYFRSLKUNMFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H8N2O/c5-3-1-2-4(7)6-3/h3H,1-2,5H2,(H,6,7).
What are the key properties of 5-aminopyrrolidin-2-one?
5-aminopyrrolidin-2-one has a molecular weight of 100.12 g/mol, XLogP of -0.82, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-aminopyrrolidin-2-one is sourced from PubChem (CID 12638466), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).