1-cyclopropyl-3-[2-(diethylamino)ethylamino]pyrrolidine-2,5-dione

C13H23N3O2 — CID 43636147

IUPAC1-cyclopropyl-3-[2-(diethylamino)ethylamino]pyrrolidine-2,5-dione
SMILESCCN(CC)CCNC1CC(=O)N(C2CC2)C1=O
InChIInChI=1S/C13H23N3O2/c1-3-15(4-2)8-7-14-11-9-12(17)16(13(11)18)10-5-6-10/h10-11,14H,3-9H2,1-2H3
InChIKeyOQXYIXMHAKCVCH-UHFFFAOYSA-N
MW253.35 g/mol
LogP0.21
Rot. Bonds7

About 1-cyclopropyl-3-[2-(diethylamino)ethylamino]pyrrolidine-2,5-dione

1-cyclopropyl-3-[2-(diethylamino)ethylamino]pyrrolidine-2,5-dione (PubChem CID 43636147) has the molecular formula C13H23N3O2 and a molecular weight of 253.35 g/mol. Its IUPAC name is 1-cyclopropyl-3-[2-(diethylamino)ethylamino]pyrrolidine-2,5-dione.

Molecular Properties

Compound Name1-cyclopropyl-3-[2-(diethylamino)ethylamino]pyrrolidine-2,5-dione
PubChem CID43636147
Molecular FormulaC13H23N3O2
Molecular Weight253.35 g/mol
Exact Mass253.18
IUPAC Name1-cyclopropyl-3-[2-(diethylamino)ethylamino]pyrrolidine-2,5-dione
SMILESCCN(CC)CCNC1CC(=O)N(C2CC2)C1=O
InChIInChI=1S/C13H23N3O2/c1-3-15(4-2)8-7-14-11-9-12(17)16(13(11)18)10-5-6-10/h10-11,14H,3-9H2,1-2H3
InChIKeyOQXYIXMHAKCVCH-UHFFFAOYSA-N
XLogP0.21
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.35
LogP ≤ 50.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-3-[2-(diethylamino)ethylamino]pyrrolidine-2,5-dione?
The IUPAC name of 1-cyclopropyl-3-[2-(diethylamino)ethylamino]pyrrolidine-2,5-dione (CID 43636147) is 1-cyclopropyl-3-[2-(diethylamino)ethylamino]pyrrolidine-2,5-dione.
What is the SMILES notation for 1-cyclopropyl-3-[2-(diethylamino)ethylamino]pyrrolidine-2,5-dione?
The canonical SMILES for 1-cyclopropyl-3-[2-(diethylamino)ethylamino]pyrrolidine-2,5-dione is CCN(CC)CCNC1CC(=O)N(C2CC2)C1=O.
What is the InChIKey of 1-cyclopropyl-3-[2-(diethylamino)ethylamino]pyrrolidine-2,5-dione?
The InChIKey is OQXYIXMHAKCVCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H23N3O2/c1-3-15(4-2)8-7-14-11-9-12(17)16(13(11)18)10-5-6-10/h10-11,14H,3-9H2,1-2H3.
What are the key properties of 1-cyclopropyl-3-[2-(diethylamino)ethylamino]pyrrolidine-2,5-dione?
1-cyclopropyl-3-[2-(diethylamino)ethylamino]pyrrolidine-2,5-dione has a molecular weight of 253.35 g/mol, XLogP of 0.21, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-3-[2-(diethylamino)ethylamino]pyrrolidine-2,5-dione is sourced from PubChem (CID 43636147), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).