Cas no 62553-50-8 (1H-Benzimidazol-2-amine, 1-[3-(4-morpholinyl)propyl]-)

1H-Benzimidazol-2-amine, 1-[3-(4-morpholinyl)propyl]- structure
62553-50-8 structure
Product Name:1H-Benzimidazol-2-amine, 1-[3-(4-morpholinyl)propyl]-
CAS No:62553-50-8
MF:C14H20N4O
MW:260.334802627563
CID:440481
PubChem ID:15955944
Update Time:2025-04-19

1H-Benzimidazol-2-amine, 1-[3-(4-morpholinyl)propyl]- Chemical and Physical Properties

Names and Identifiers

    • 1H-Benzimidazol-2-amine, 1-[3-(4-morpholinyl)propyl]-
    • 1-(3-morpholin-4-ylpropyl)benzimidazol-2-amine
    • SCHEMBL11712420
    • DTXSID50580468
    • 1-[3-(Morpholin-4-yl)propyl]-1H-benzimidazol-2-amine
    • CHEMBL225505
    • 62553-50-8
    • Inchi: 1S/C14H20N4O/c15-14-16-12-4-1-2-5-13(12)18(14)7-3-6-17-8-10-19-11-9-17/h1-2,4-5H,3,6-11H2,(H2,15,16)
    • InChI Key: SQPXFDPMXKYBRF-UHFFFAOYSA-N
    • SMILES: O1CCN(CC1)CCCN1C(N)=NC2C=CC=CC1=2

Computed Properties

  • Exact Mass: 260.1639
  • Monoisotopic Mass: 260.16371127g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 19
  • Rotatable Bond Count: 4
  • Complexity: 283
  • 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: 56.3?2

Experimental Properties

  • PSA: 56.31
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