Cas no 5135-54-6 (1-(3-dimethylaminopropyl)-1h-pyrrole-2,5-dione)

1-(3-dimethylaminopropyl)-1h-pyrrole-2,5-dione structure
5135-54-6 structure
Product Name:1-(3-dimethylaminopropyl)-1h-pyrrole-2,5-dione
CAS No:5135-54-6
MF:C9H14N2O2
MW:182.219662189484
CID:935210
PubChem ID:151256
Update Time:2025-04-19

1-(3-dimethylaminopropyl)-1h-pyrrole-2,5-dione Chemical and Physical Properties

Names and Identifiers

    • 1-(3-dimethylaminopropyl)-1h-pyrrole-2,5-dione
    • 1-[3-(dimethylamino)propyl]pyrrole-2,5-dione
    • DTXSID40199346
    • SCHEMBL181338
    • DM-Pam
    • AKOS000249138
    • 1H-Pyrrole-2,5-dione, 1-(3-(dimethylamino)propyl)-
    • 5135-54-6
    • Inchi: 1S/C9H14N2O2/c1-10(2)6-3-7-11-8(12)4-5-9(11)13/h4-5H,3,6-7H2,1-2H3
    • InChI Key: VIENZRUMYAUKFY-UHFFFAOYSA-N
    • SMILES: O=C1C=CC(N1CCCN(C)C)=O

Computed Properties

  • Exact Mass: 182.105527694g/mol
  • Monoisotopic Mass: 182.105527694g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 4
  • Complexity: 228
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 0.9
  • Topological Polar Surface Area: 40.6?2
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