1-[2-(2,5-dioxopyrrolidin-1-yl)propan-2-yl]pyrrolidine-2,5-dione

C11H14N2O4 — CID 58388473

IUPAC1-[2-(2,5-dioxopyrrolidin-1-yl)propan-2-yl]pyrrolidine-2,5-dione
SMILESCC(C)(N1C(=O)CCC1=O)N1C(=O)CCC1=O
InChIInChI=1S/C11H14N2O4/c1-11(2,12-7(14)3-4-8(12)15)13-9(16)5-6-10(13)17/h3-6H2,1-2H3
InChIKeyUAFUEYNUWIKIFG-UHFFFAOYSA-N
MW238.24 g/mol
LogP0.02
Rot. Bonds2

About 1-[2-(2,5-dioxopyrrolidin-1-yl)propan-2-yl]pyrrolidine-2,5-dione

1-[2-(2,5-dioxopyrrolidin-1-yl)propan-2-yl]pyrrolidine-2,5-dione (PubChem CID 58388473) has the molecular formula C11H14N2O4 and a molecular weight of 238.24 g/mol. Its IUPAC name is 1-[2-(2,5-dioxopyrrolidin-1-yl)propan-2-yl]pyrrolidine-2,5-dione.

Molecular Properties

Compound Name1-[2-(2,5-dioxopyrrolidin-1-yl)propan-2-yl]pyrrolidine-2,5-dione
PubChem CID58388473
Molecular FormulaC11H14N2O4
Molecular Weight238.24 g/mol
Exact Mass238.10
IUPAC Name1-[2-(2,5-dioxopyrrolidin-1-yl)propan-2-yl]pyrrolidine-2,5-dione
SMILESCC(C)(N1C(=O)CCC1=O)N1C(=O)CCC1=O
InChIInChI=1S/C11H14N2O4/c1-11(2,12-7(14)3-4-8(12)15)13-9(16)5-6-10(13)17/h3-6H2,1-2H3
InChIKeyUAFUEYNUWIKIFG-UHFFFAOYSA-N
XLogP0.02
TPSA74.76 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.24
LogP ≤ 50.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

1-[2-(2,5-dioxopyrrolidin-1-yl)butan-2-yl]piperidine-2,6-dione
CID 138667500
1-(3-methylhexan-3-yl)pyrrolidine-2,5-dione
CID 134199523
1-(1-hydroxy-2-methylbutan-2-yl)pyrrolidine-2,5-dione
CID 64558407
1-(1-amino-2-methylpropan-2-yl)azepane-2,7-dione
CID 63194643
2-(2,5-dioxopyrrolidin-1-yl)-2-methylbutanethioamide
CID 61123128
CID 58928873
CID 58928873
2-(2,5-dioxopyrrolidin-1-yl)-2-ethylbutanoic acid
CID 78969508
azane;1-hydroxypyrrolidine-2,5-dione
CID 11073454
(2S)-2-(2,5-dioxopyrrolidin-1-yl)-2-hydroxy-3-methylbutanoic acid
CID 68872247
1-[1-chloro-2-(4-methylphenyl)propan-2-yl]pyrrolidine-2,5-dione
CID 23271640
1-(1-hydroxy-2-methylbutan-2-yl)azepane-2,7-dione
CID 64558404
3-(2,7-dioxoazepan-1-yl)-3-methylbutanoic acid
CID 64700178

Frequently Asked Questions

What is the IUPAC name of 1-[2-(2,5-dioxopyrrolidin-1-yl)propan-2-yl]pyrrolidine-2,5-dione?
The IUPAC name of 1-[2-(2,5-dioxopyrrolidin-1-yl)propan-2-yl]pyrrolidine-2,5-dione (CID 58388473) is 1-[2-(2,5-dioxopyrrolidin-1-yl)propan-2-yl]pyrrolidine-2,5-dione.
What is the SMILES notation for 1-[2-(2,5-dioxopyrrolidin-1-yl)propan-2-yl]pyrrolidine-2,5-dione?
The canonical SMILES for 1-[2-(2,5-dioxopyrrolidin-1-yl)propan-2-yl]pyrrolidine-2,5-dione is CC(C)(N1C(=O)CCC1=O)N1C(=O)CCC1=O.
What is the InChIKey of 1-[2-(2,5-dioxopyrrolidin-1-yl)propan-2-yl]pyrrolidine-2,5-dione?
The InChIKey is UAFUEYNUWIKIFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2O4/c1-11(2,12-7(14)3-4-8(12)15)13-9(16)5-6-10(13)17/h3-6H2,1-2H3.
What are the key properties of 1-[2-(2,5-dioxopyrrolidin-1-yl)propan-2-yl]pyrrolidine-2,5-dione?
1-[2-(2,5-dioxopyrrolidin-1-yl)propan-2-yl]pyrrolidine-2,5-dione has a molecular weight of 238.24 g/mol, XLogP of 0.02, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(2,5-dioxopyrrolidin-1-yl)propan-2-yl]pyrrolidine-2,5-dione is sourced from PubChem (CID 58388473), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).