Cas no 188816-65-1 (4H-Quinolizine-1-carbonitrile, 3-amino-4-oxo-)

4H-Quinolizine-1-carbonitrile, 3-amino-4-oxo- structure
188816-65-1 structure
Product Name:4H-Quinolizine-1-carbonitrile, 3-amino-4-oxo-
CAS No:188816-65-1
MF:C10H7N3O
MW:185.182081460953
MDL:MFCD01815135
CID:1380548
PubChem ID:1477484
Update Time:2025-04-20

4H-Quinolizine-1-carbonitrile, 3-amino-4-oxo- Chemical and Physical Properties

Names and Identifiers

    • 4H-Quinolizine-1-carbonitrile, 3-amino-4-oxo-
    • 3-amino-1-cyano-4H-pyrido[1,2-a]pyridin-4-one
    • MFCD01815135
    • AKOS006278232
    • 3-amino-4-oxoquinolizine-1-carbonitrile
    • 188816-65-1
    • 3-amino-4-oxo-4H-quinolizine-1-carbonitrile
    • 4P-723
    • MDL: MFCD01815135
    • Inchi: 1S/C10H7N3O/c11-6-7-5-8(12)10(14)13-4-2-1-3-9(7)13/h1-5H,12H2
    • InChI Key: OTARWGBLVIOEMZ-UHFFFAOYSA-N
    • SMILES: O=C1C(=CC(C#N)=C2C=CC=CN21)N

Computed Properties

  • Exact Mass: 185.05901
  • Monoisotopic Mass: 185.059
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 0
  • Complexity: 471
  • 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: 0.3
  • Topological Polar Surface Area: 70.1?2

Experimental Properties

  • PSA: 70.12

4H-Quinolizine-1-carbonitrile, 3-amino-4-oxo- Pricemore >>

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