1-(1-aminopropyl)pyrrolidine-2,5-dione

C7H12N2O2 — CID 155092296

IUPAC1-(1-aminopropyl)pyrrolidine-2,5-dione
SMILESCCC(N)N1C(=O)CCC1=O
InChIInChI=1S/C7H12N2O2/c1-2-5(8)9-6(10)3-4-7(9)11/h5H,2-4,8H2,1H3
InChIKeyOSISYEWASJUGBN-UHFFFAOYSA-N
MW156.19 g/mol
LogP-0.17
Rot. Bonds2

About 1-(1-aminopropyl)pyrrolidine-2,5-dione

1-(1-aminopropyl)pyrrolidine-2,5-dione (PubChem CID 155092296) has the molecular formula C7H12N2O2 and a molecular weight of 156.19 g/mol. Its IUPAC name is 1-(1-aminopropyl)pyrrolidine-2,5-dione.

Molecular Properties

Compound Name1-(1-aminopropyl)pyrrolidine-2,5-dione
PubChem CID155092296
Molecular FormulaC7H12N2O2
Molecular Weight156.19 g/mol
Exact Mass156.09
IUPAC Name1-(1-aminopropyl)pyrrolidine-2,5-dione
SMILESCCC(N)N1C(=O)CCC1=O
InChIInChI=1S/C7H12N2O2/c1-2-5(8)9-6(10)3-4-7(9)11/h5H,2-4,8H2,1H3
InChIKeyOSISYEWASJUGBN-UHFFFAOYSA-N
XLogP-0.17
TPSA63.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.19
LogP ≤ 5-0.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phthalimide', 'substructure': 'N/A'}

Analyze 1-(1-aminopropyl)pyrrolidine-2,5-dione 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-(1-aminopropyl)pyrrolidine-2,5-dione?
The IUPAC name of 1-(1-aminopropyl)pyrrolidine-2,5-dione (CID 155092296) is 1-(1-aminopropyl)pyrrolidine-2,5-dione.
What is the SMILES notation for 1-(1-aminopropyl)pyrrolidine-2,5-dione?
The canonical SMILES for 1-(1-aminopropyl)pyrrolidine-2,5-dione is CCC(N)N1C(=O)CCC1=O.
What is the InChIKey of 1-(1-aminopropyl)pyrrolidine-2,5-dione?
The InChIKey is OSISYEWASJUGBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12N2O2/c1-2-5(8)9-6(10)3-4-7(9)11/h5H,2-4,8H2,1H3.
What are the key properties of 1-(1-aminopropyl)pyrrolidine-2,5-dione?
1-(1-aminopropyl)pyrrolidine-2,5-dione has a molecular weight of 156.19 g/mol, XLogP of -0.17, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-aminopropyl)pyrrolidine-2,5-dione is sourced from PubChem (CID 155092296), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).