3-amino-1-propan-2-ylpyrrolidin-2-one

C7H14N2O — CID 23588961

IUPAC3-amino-1-propan-2-ylpyrrolidin-2-one
SMILESCC(C)N1CCC(N)C1=O
InChIInChI=1S/C7H14N2O/c1-5(2)9-4-3-6(8)7(9)10/h5-6H,3-4,8H2,1-2H3
InChIKeyUSJARTFHYOVZDH-UHFFFAOYSA-N
MW142.20 g/mol
LogP-0.05
Rot. Bonds1

About 3-amino-1-propan-2-ylpyrrolidin-2-one

3-amino-1-propan-2-ylpyrrolidin-2-one (PubChem CID 23588961) has the molecular formula C7H14N2O and a molecular weight of 142.20 g/mol. Its IUPAC name is 3-amino-1-propan-2-ylpyrrolidin-2-one.

Molecular Properties

Compound Name3-amino-1-propan-2-ylpyrrolidin-2-one
PubChem CID23588961
Molecular FormulaC7H14N2O
Molecular Weight142.20 g/mol
Exact Mass142.11
IUPAC Name3-amino-1-propan-2-ylpyrrolidin-2-one
SMILESCC(C)N1CCC(N)C1=O
InChIInChI=1S/C7H14N2O/c1-5(2)9-4-3-6(8)7(9)10/h5-6H,3-4,8H2,1-2H3
InChIKeyUSJARTFHYOVZDH-UHFFFAOYSA-N
XLogP-0.05
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.20
LogP ≤ 5-0.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 3-amino-1-propan-2-ylpyrrolidin-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-amino-1-propan-2-ylpyrrolidin-2-one?
The IUPAC name of 3-amino-1-propan-2-ylpyrrolidin-2-one (CID 23588961) is 3-amino-1-propan-2-ylpyrrolidin-2-one.
What is the SMILES notation for 3-amino-1-propan-2-ylpyrrolidin-2-one?
The canonical SMILES for 3-amino-1-propan-2-ylpyrrolidin-2-one is CC(C)N1CCC(N)C1=O.
What is the InChIKey of 3-amino-1-propan-2-ylpyrrolidin-2-one?
The InChIKey is USJARTFHYOVZDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14N2O/c1-5(2)9-4-3-6(8)7(9)10/h5-6H,3-4,8H2,1-2H3.
What are the key properties of 3-amino-1-propan-2-ylpyrrolidin-2-one?
3-amino-1-propan-2-ylpyrrolidin-2-one has a molecular weight of 142.20 g/mol, XLogP of -0.05, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-1-propan-2-ylpyrrolidin-2-one is sourced from PubChem (CID 23588961), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).