(2,5-dioxopyrrolidin-1-yl) 2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]acetate

C13H21NO8 — CID 58067983

IUPAC(2,5-dioxopyrrolidin-1-yl) 2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]acetate
SMILESCOCCOCCOCCOCC(=O)ON1C(=O)CCC1=O
InChIInChI=1S/C13H21NO8/c1-18-4-5-19-6-7-20-8-9-21-10-13(17)22-14-11(15)2-3-12(14)16/h2-10H2,1H3
InChIKeyGZMGHDVOWSDCPZ-UHFFFAOYSA-N
MW319.31 g/mol
LogP-0.71
Rot. Bonds12

About (2,5-dioxopyrrolidin-1-yl) 2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]acetate

(2,5-dioxopyrrolidin-1-yl) 2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]acetate (PubChem CID 58067983) has the molecular formula C13H21NO8 and a molecular weight of 319.31 g/mol. Its IUPAC name is (2,5-dioxopyrrolidin-1-yl) 2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]acetate.

Molecular Properties

Compound Name(2,5-dioxopyrrolidin-1-yl) 2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]acetate
PubChem CID58067983
Molecular FormulaC13H21NO8
Molecular Weight319.31 g/mol
Exact Mass319.13
IUPAC Name(2,5-dioxopyrrolidin-1-yl) 2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]acetate
SMILESCOCCOCCOCCOCC(=O)ON1C(=O)CCC1=O
InChIInChI=1S/C13H21NO8/c1-18-4-5-19-6-7-20-8-9-21-10-13(17)22-14-11(15)2-3-12(14)16/h2-10H2,1H3
InChIKeyGZMGHDVOWSDCPZ-UHFFFAOYSA-N
XLogP-0.71
TPSA100.60 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds12
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500319.31
LogP ≤ 5-0.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

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

Analyze (2,5-dioxopyrrolidin-1-yl) 2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]acetate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (2,5-dioxopyrrolidin-1-yl) 2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]acetate?
The IUPAC name of (2,5-dioxopyrrolidin-1-yl) 2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]acetate (CID 58067983) is (2,5-dioxopyrrolidin-1-yl) 2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]acetate.
What is the SMILES notation for (2,5-dioxopyrrolidin-1-yl) 2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]acetate?
The canonical SMILES for (2,5-dioxopyrrolidin-1-yl) 2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]acetate is COCCOCCOCCOCC(=O)ON1C(=O)CCC1=O.
What is the InChIKey of (2,5-dioxopyrrolidin-1-yl) 2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]acetate?
The InChIKey is GZMGHDVOWSDCPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21NO8/c1-18-4-5-19-6-7-20-8-9-21-10-13(17)22-14-11(15)2-3-12(14)16/h2-10H2,1H3.
What are the key properties of (2,5-dioxopyrrolidin-1-yl) 2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]acetate?
(2,5-dioxopyrrolidin-1-yl) 2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]acetate has a molecular weight of 319.31 g/mol, XLogP of -0.71, 12 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for (2,5-dioxopyrrolidin-1-yl) 2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]acetate is sourced from PubChem (CID 58067983), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).