3-[4-(Isopentyloxy)phenyl]-3-methylpyrrolidine-2,5-dione

Substructure search Find similar structures

Basic information

CAS: 55755-87-8
Standard SMILES: CC(C)CCOc1ccc(C2(C)CC(=O)NC2=O)cc1
InChIKey: MOVGKIDBGCWOMC-UHFFFAOYSA-N
Molecular formula: C16H21NO3
Average molar mass: 275.34 g/mol
Monoisotopic mass: 275.15214353

Names & identifiers

Preferred name: 3-[4-(Isopentyloxy)phenyl]-3-methylpyrrolidine-2,5-dione
IUPAC: 3-methyl-3-[4-(3-methylbutoxy)phenyl]pyrrolidine-2,5-dione

Names & synonyms

55755-87-83-[4-(Isopentyloxy)phenyl]-3-methylpyrrolidine-2,5-dione3-methyl-3-[4-(3-methylbutoxy)phenyl]pyrrolidine-2,5-dioneOprea1_365518DTXSID60342731MOVGKIDBGCWOMC-UHFFFAOYSA-N2,5-Pyrrolidinedione, 3-methyl-3-[4-(3-methylbutoxy)phenyl]-AG-205/119573933-[4-(Isopentyloxy)phenyl]-3-methyl-2,5-pyrrolidinedione #

Database identifiers

CAS: 55755-87-8
PubChem CID: 584063
DTXSID: DTXSID60342731

Properties

Computed structural properties

XLogP: 2.7
Topological polar surface area: 55.4 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 3
Rotatable bonds: 5
Heavy atoms: 20
Formal charge: 0
Complexity: 372

Related reactions

0 records

New reaction record

No reaction records under the current filter.

Compound notes

Loading…