N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(2,5-dioxopyrrolidin-1-yl)acetamide

HCID 7819782

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Basic information

CAS: 56997-76-3
Standard SMILES: COc1ccc(CCNC(=O)CN2C(=O)CCC2=O)cc1OC
InChIKey: WEVIGPXUMLZCPF-UHFFFAOYSA-N
Molecular formula: C16H20N2O5
Average molar mass: 320.34 g/mol
Monoisotopic mass: 320.13722174

Names & identifiers

Preferred name: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(2,5-dioxopyrrolidin-1-yl)acetamide
IUPAC: N-[2-(3,4-dimethoxyphenyl)ethyl]-2-(2,5-dioxopyrrolidin-1-yl)acetamide

Names & synonyms

DTXSID601167499N-[2-(3,4-Dimethoxyphenyl)ethyl]-2,5-dioxo-1-pyrrolidineacetamideN-[2-(3,4-dimethoxyphenyl)ethyl]-2-(2,5-dioxopyrrolidin-1-yl)acetamide56997-76-3

Database identifiers

CAS: 56997-76-3
PubChem CID: 7819782
DTXSID: DTXSID601167499

Properties

Computed structural properties

XLogP: 0.4
Topological polar surface area: 84.9 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 5
Rotatable bonds: 7
Heavy atoms: 23
Formal charge: 0
Complexity: 438

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