Cas no 656250-11-2 (Acetamide, N-[3-(2-aminophenyl)-3-oxopropyl]-)

Acetamide, N-[3-(2-aminophenyl)-3-oxopropyl]- structure
656250-11-2 structure
Product Name:Acetamide, N-[3-(2-aminophenyl)-3-oxopropyl]-
CAS No:656250-11-2
MF:C11H14N2O2
MW:206.241062641144
CID:397943
PubChem ID:21777754
Update Time:2025-04-19

Acetamide, N-[3-(2-aminophenyl)-3-oxopropyl]- Chemical and Physical Properties

Names and Identifiers

    • Acetamide, N-[3-(2-aminophenyl)-3-oxopropyl]-
    • N-[3-(2-aminophenyl)-3-oxopropyl]acetamide
    • 656250-11-2
    • CHEBI:199133
    • N-Acetylkynuramine
    • SCHEMBL20556420
    • DTXSID10617921
    • Inchi: 1S/C11H14N2O2/c1-8(14)13-7-6-11(15)9-4-2-3-5-10(9)12/h2-5H,6-7,12H2,1H3,(H,13,14)
    • InChI Key: YDSXWKCTDWHLBK-UHFFFAOYSA-N
    • SMILES: O=C(C1C=CC=CC=1N)CCNC(C)=O

Computed Properties

  • Exact Mass: 206.10562
  • Monoisotopic Mass: 206.105527694g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 15
  • Rotatable Bond Count: 4
  • Complexity: 241
  • 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: 72.2?2

Experimental Properties

  • PSA: 72.19
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