1-cyclopropyl-3-(pentan-3-ylamino)pyrrolidine-2,5-dione

C12H20N2O2 — CID 43636111

IUPAC1-cyclopropyl-3-(pentan-3-ylamino)pyrrolidine-2,5-dione
SMILESCCC(CC)NC1CC(=O)N(C2CC2)C1=O
InChIInChI=1S/C12H20N2O2/c1-3-8(4-2)13-10-7-11(15)14(12(10)16)9-5-6-9/h8-10,13H,3-7H2,1-2H3
InChIKeyMLISHRQENLMOIV-UHFFFAOYSA-N
MW224.30 g/mol
LogP1.05
Rot. Bonds5

About 1-cyclopropyl-3-(pentan-3-ylamino)pyrrolidine-2,5-dione

1-cyclopropyl-3-(pentan-3-ylamino)pyrrolidine-2,5-dione (PubChem CID 43636111) has the molecular formula C12H20N2O2 and a molecular weight of 224.30 g/mol. Its IUPAC name is 1-cyclopropyl-3-(pentan-3-ylamino)pyrrolidine-2,5-dione.

Molecular Properties

Compound Name1-cyclopropyl-3-(pentan-3-ylamino)pyrrolidine-2,5-dione
PubChem CID43636111
Molecular FormulaC12H20N2O2
Molecular Weight224.30 g/mol
Exact Mass224.15
IUPAC Name1-cyclopropyl-3-(pentan-3-ylamino)pyrrolidine-2,5-dione
SMILESCCC(CC)NC1CC(=O)N(C2CC2)C1=O
InChIInChI=1S/C12H20N2O2/c1-3-8(4-2)13-10-7-11(15)14(12(10)16)9-5-6-9/h8-10,13H,3-7H2,1-2H3
InChIKeyMLISHRQENLMOIV-UHFFFAOYSA-N
XLogP1.05
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.30
LogP ≤ 51.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 1-cyclopropyl-3-(pentan-3-ylamino)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

Related Compounds

Pramiracetam
CID 51712
2-[4-(1-Methyl-2,5-dioxopyrrolidin-3-yl)piperazin-1-yl]acetamide
CID 3631511
3-(4-Ethylpiperazin-1-yl)pyrrolidine-2,5-dione
CID 2989013
1-Pyrrolidineacetamide, N-(2-((1-methylethyl)amino)-2-oxoethyl)-2-oxo-
CID 3050861
1-Pyrrolidineacetamide, N-(2-amino-2-oxoethyl)-alpha-methyl-2-oxo-
CID 3050865
1-Pyrrolidineacetamide, N-(2-amino-2-oxoethyl)-alpha-ethyl-2-oxo-
CID 3050866
3-(Dimethylamino)pyrrolidine-2,5-dione
CID 12550570
3-(Methylamino)-2,5-pyrrolidinedione
CID 12695971
Pramiracetam Hydrochloride
CID 3050410
2-[4-(1-ethyl-2,5-dioxo-3-pyrrolidinyl)-1-piperazinyl]-N-isopropylacetamide
CID 2983546
N-cyclopropyl-N'-[(1-ethylpyrrolidin-2-yl)methyl]ethanediamide
CID 3156687
(S)-3-amino-4-oxo-4-(pyrrolidin-1-yl)butanamide
CID 11229192

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-3-(pentan-3-ylamino)pyrrolidine-2,5-dione?
The IUPAC name of 1-cyclopropyl-3-(pentan-3-ylamino)pyrrolidine-2,5-dione (CID 43636111) is 1-cyclopropyl-3-(pentan-3-ylamino)pyrrolidine-2,5-dione.
What is the SMILES notation for 1-cyclopropyl-3-(pentan-3-ylamino)pyrrolidine-2,5-dione?
The canonical SMILES for 1-cyclopropyl-3-(pentan-3-ylamino)pyrrolidine-2,5-dione is CCC(CC)NC1CC(=O)N(C2CC2)C1=O.
What is the InChIKey of 1-cyclopropyl-3-(pentan-3-ylamino)pyrrolidine-2,5-dione?
The InChIKey is MLISHRQENLMOIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2O2/c1-3-8(4-2)13-10-7-11(15)14(12(10)16)9-5-6-9/h8-10,13H,3-7H2,1-2H3.
What are the key properties of 1-cyclopropyl-3-(pentan-3-ylamino)pyrrolidine-2,5-dione?
1-cyclopropyl-3-(pentan-3-ylamino)pyrrolidine-2,5-dione has a molecular weight of 224.30 g/mol, XLogP of 1.05, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-3-(pentan-3-ylamino)pyrrolidine-2,5-dione is sourced from PubChem (CID 43636111), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).