1-cyclopropyl-3-(2-ethoxypropylamino)pyrrolidine-2,5-dione

C12H20N2O3 — CID 113477226

IUPAC1-cyclopropyl-3-(2-ethoxypropylamino)pyrrolidine-2,5-dione
SMILESCCOC(C)CNC1CC(=O)N(C2CC2)C1=O
InChIInChI=1S/C12H20N2O3/c1-3-17-8(2)7-13-10-6-11(15)14(12(10)16)9-4-5-9/h8-10,13H,3-7H2,1-2H3
InChIKeyVBUWJWNTRDDEIT-UHFFFAOYSA-N
MW240.30 g/mol
LogP0.29
Rot. Bonds6

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

1-cyclopropyl-3-(2-ethoxypropylamino)pyrrolidine-2,5-dione (PubChem CID 113477226) has the molecular formula C12H20N2O3 and a molecular weight of 240.30 g/mol. Its IUPAC name is 1-cyclopropyl-3-(2-ethoxypropylamino)pyrrolidine-2,5-dione.

Molecular Properties

Compound Name1-cyclopropyl-3-(2-ethoxypropylamino)pyrrolidine-2,5-dione
PubChem CID113477226
Molecular FormulaC12H20N2O3
Molecular Weight240.30 g/mol
Exact Mass240.15
IUPAC Name1-cyclopropyl-3-(2-ethoxypropylamino)pyrrolidine-2,5-dione
SMILESCCOC(C)CNC1CC(=O)N(C2CC2)C1=O
InChIInChI=1S/C12H20N2O3/c1-3-17-8(2)7-13-10-6-11(15)14(12(10)16)9-4-5-9/h8-10,13H,3-7H2,1-2H3
InChIKeyVBUWJWNTRDDEIT-UHFFFAOYSA-N
XLogP0.29
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.30
LogP ≤ 50.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

1-cyclopentyl-3-(2-propan-2-yloxyethylamino)pyrrolidine-2,5-dione
CID 104759895
1-cyclopropyl-3-(propan-2-ylamino)pyrrolidine-2,5-dione
CID 43636083
1-cyclopropyl-3-(pentan-3-ylamino)pyrrolidine-2,5-dione
CID 43636111
1-cyclopropyl-3-[2-(diethylamino)ethylamino]pyrrolidine-2,5-dione
CID 43636147
3-[(1-cyclopropyl-2,5-dioxopyrrolidin-3-yl)amino]-N,N-diethylpropanamide
CID 60925606
1-cyclopropyl-3-(3-methylbutan-2-ylamino)pyrrolidine-2,5-dione
CID 43636669
1-cyclopentyl-3-[(2-ethoxy-2-methylpropyl)amino]pyrrolidine-2,5-dione
CID 114941620
1-cyclopropyl-3-(2-methylsulfonylethylamino)pyrrolidine-2,5-dione
CID 54934783
1-cyclohexyl-3-(cyclopropylmethylamino)pyrrolidine-2,5-dione
CID 43637329
3-(butylamino)-1-cycloheptylpyrrolidine-2,5-dione
CID 43637456
1-cyclopentyl-3-(pentylamino)pyrrolidine-2,5-dione
CID 43637430
1-cyclopropyl-3-[(1-methoxycyclobutyl)methylamino]pyrrolidine-2,5-dione
CID 114118975

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-3-(2-ethoxypropylamino)pyrrolidine-2,5-dione?
The IUPAC name of 1-cyclopropyl-3-(2-ethoxypropylamino)pyrrolidine-2,5-dione (CID 113477226) is 1-cyclopropyl-3-(2-ethoxypropylamino)pyrrolidine-2,5-dione.
What is the SMILES notation for 1-cyclopropyl-3-(2-ethoxypropylamino)pyrrolidine-2,5-dione?
The canonical SMILES for 1-cyclopropyl-3-(2-ethoxypropylamino)pyrrolidine-2,5-dione is CCOC(C)CNC1CC(=O)N(C2CC2)C1=O.
What is the InChIKey of 1-cyclopropyl-3-(2-ethoxypropylamino)pyrrolidine-2,5-dione?
The InChIKey is VBUWJWNTRDDEIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2O3/c1-3-17-8(2)7-13-10-6-11(15)14(12(10)16)9-4-5-9/h8-10,13H,3-7H2,1-2H3.
What are the key properties of 1-cyclopropyl-3-(2-ethoxypropylamino)pyrrolidine-2,5-dione?
1-cyclopropyl-3-(2-ethoxypropylamino)pyrrolidine-2,5-dione has a molecular weight of 240.30 g/mol, XLogP of 0.29, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-3-(2-ethoxypropylamino)pyrrolidine-2,5-dione is sourced from PubChem (CID 113477226), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).