Cas no 93111-57-0 (Propanamide,N-[2-(butylamino)ethyl]-)

Propanamide,N-[2-(butylamino)ethyl]- structure
93111-57-0 structure
Product Name:Propanamide,N-[2-(butylamino)ethyl]-
CAS No:93111-57-0
MF:C9H20N2O
MW:172.267902374268
CID:801184
PubChem ID:45123022
Update Time:2025-04-19

Propanamide,N-[2-(butylamino)ethyl]- Chemical and Physical Properties

Names and Identifiers

    • Propanamide,N-[2-(butylamino)ethyl]-
    • N-(2-(Butylamino)ethyl)propionamide
    • 93111-57-0
    • Inchi: 1S/C9H20N2O/c1-3-5-6-10-7-8-11-9(12)4-2/h10H,3-8H2,1-2H3,(H,11,12)
    • InChI Key: MNTUSHQCRVMKRA-UHFFFAOYSA-N
    • SMILES: O=C(CC)NCCNCCCC

Computed Properties

  • Exact Mass: 172.158
  • Monoisotopic Mass: 172.158
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 7
  • Complexity: 115
  • 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
  • Topological Polar Surface Area: 41.1A^2
  • XLogP3: 0.8
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