Cas no 288251-78-5 (5-Amino-2-(4-hydroxypiperidin-1-yl)benzonitrile)

5-Amino-2-(4-hydroxypiperidin-1-yl)benzonitrile structure
288251-78-5 structure
Product Name:5-Amino-2-(4-hydroxypiperidin-1-yl)benzonitrile
CAS No:288251-78-5
MF:C12H15N3O
MW:217.267002344131
CID:1436889
PubChem ID:21942313
Update Time:2025-04-20

5-Amino-2-(4-hydroxypiperidin-1-yl)benzonitrile Chemical and Physical Properties

Names and Identifiers

    • Benzonitrile, 5-amino-2-(4-hydroxy-1-piperidinyl)-
    • 5-amino-2-(4-hydroxypiperidino)benzonitrile
    • AKOS010538810
    • 5-amino-2-(4-hydroxypiperidin-1-yl)benzonitrile
    • DA-42892
    • EN300-91662
    • SCHEMBL855438
    • 288251-78-5
    • VXSRJNOLMKZWDC-UHFFFAOYSA-N
    • CS-0264067
    • 5-Amino-2-(4-hydroxypiperidin-1-yl)benzonitrile
    • Inchi: 1S/C12H15N3O/c13-8-9-7-10(14)1-2-12(9)15-5-3-11(16)4-6-15/h1-2,7,11,16H,3-6,14H2
    • InChI Key: VXSRJNOLMKZWDC-UHFFFAOYSA-N
    • SMILES: OC1CCN(C2C=CC(=CC=2C#N)N)CC1

Computed Properties

  • Exact Mass: 217.12165
  • Monoisotopic Mass: 217.121512110g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 1
  • Complexity: 277
  • 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: 1
  • Topological Polar Surface Area: 73.3?2

Experimental Properties

  • PSA: 73.28

5-Amino-2-(4-hydroxypiperidin-1-yl)benzonitrile Pricemore >>

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