(2,5-dioxopyrrolidin-1-yl) 2-(3-methyl-2,5-dioxopyrrol-1-yl)acetate

C11H10N2O6 — CID 58461548

IUPAC(2,5-dioxopyrrolidin-1-yl) 2-(3-methyl-2,5-dioxopyrrol-1-yl)acetate
SMILESCC1=CC(=O)N(CC(=O)ON2C(=O)CCC2=O)C1=O
InChIInChI=1S/C11H10N2O6/c1-6-4-9(16)12(11(6)18)5-10(17)19-13-7(14)2-3-8(13)15/h4H,2-3,5H2,1H3
InChIKeyGFOWLQZCMXPGIG-UHFFFAOYSA-N
MW266.21 g/mol
LogP-1.09
Rot. Bonds3

About (2,5-dioxopyrrolidin-1-yl) 2-(3-methyl-2,5-dioxopyrrol-1-yl)acetate

(2,5-dioxopyrrolidin-1-yl) 2-(3-methyl-2,5-dioxopyrrol-1-yl)acetate (PubChem CID 58461548) has the molecular formula C11H10N2O6 and a molecular weight of 266.21 g/mol. Its IUPAC name is (2,5-dioxopyrrolidin-1-yl) 2-(3-methyl-2,5-dioxopyrrol-1-yl)acetate.

Molecular Properties

Compound Name(2,5-dioxopyrrolidin-1-yl) 2-(3-methyl-2,5-dioxopyrrol-1-yl)acetate
PubChem CID58461548
Molecular FormulaC11H10N2O6
Molecular Weight266.21 g/mol
Exact Mass266.05
IUPAC Name(2,5-dioxopyrrolidin-1-yl) 2-(3-methyl-2,5-dioxopyrrol-1-yl)acetate
SMILESCC1=CC(=O)N(CC(=O)ON2C(=O)CCC2=O)C1=O
InChIInChI=1S/C11H10N2O6/c1-6-4-9(16)12(11(6)18)5-10(17)19-13-7(14)2-3-8(13)15/h4H,2-3,5H2,1H3
InChIKeyGFOWLQZCMXPGIG-UHFFFAOYSA-N
XLogP-1.09
TPSA101.06 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.21
LogP ≤ 5-1.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (2,5-dioxopyrrolidin-1-yl) 2-(3-methyl-2,5-dioxopyrrol-1-yl)acetate?
The IUPAC name of (2,5-dioxopyrrolidin-1-yl) 2-(3-methyl-2,5-dioxopyrrol-1-yl)acetate (CID 58461548) is (2,5-dioxopyrrolidin-1-yl) 2-(3-methyl-2,5-dioxopyrrol-1-yl)acetate.
What is the SMILES notation for (2,5-dioxopyrrolidin-1-yl) 2-(3-methyl-2,5-dioxopyrrol-1-yl)acetate?
The canonical SMILES for (2,5-dioxopyrrolidin-1-yl) 2-(3-methyl-2,5-dioxopyrrol-1-yl)acetate is CC1=CC(=O)N(CC(=O)ON2C(=O)CCC2=O)C1=O.
What is the InChIKey of (2,5-dioxopyrrolidin-1-yl) 2-(3-methyl-2,5-dioxopyrrol-1-yl)acetate?
The InChIKey is GFOWLQZCMXPGIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10N2O6/c1-6-4-9(16)12(11(6)18)5-10(17)19-13-7(14)2-3-8(13)15/h4H,2-3,5H2,1H3.
What are the key properties of (2,5-dioxopyrrolidin-1-yl) 2-(3-methyl-2,5-dioxopyrrol-1-yl)acetate?
(2,5-dioxopyrrolidin-1-yl) 2-(3-methyl-2,5-dioxopyrrol-1-yl)acetate has a molecular weight of 266.21 g/mol, XLogP of -1.09, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (2,5-dioxopyrrolidin-1-yl) 2-(3-methyl-2,5-dioxopyrrol-1-yl)acetate is sourced from PubChem (CID 58461548), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).