Cas no 5051-97-8 (2,6-Pyridinediamine, N,N'-diphenyl-)

2,6-Pyridinediamine, N,N'-diphenyl- structure
5051-97-8 structure
Product Name:2,6-Pyridinediamine, N,N'-diphenyl-
CAS No:5051-97-8
MF:C17H15N3
MW:261.321103334427
CID:364730
PubChem ID:1311254
Update Time:2025-04-19

2,6-Pyridinediamine, N,N'-diphenyl- Chemical and Physical Properties

Names and Identifiers

    • 2,6-Pyridinediamine, N,N'-diphenyl-
    • 2-N,6-N-diphenylpyridine-2,6-diamine
    • 5051-97-8
    • N,N'-diphenylpyridine-2,6-diamine
    • SMR000142433
    • HMS2313F22
    • AKOS005386787
    • DTXSID20361701
    • N,N'-diphenyl-2,6-pyridinediamine
    • MLS000534997
    • SCHEMBL3759875
    • CHEMBL1392552
    • BDBM32278
    • (6-anilino-2-pyridyl)-phenyl-amine
    • cid_1311254
    • N2,N6-diphenylpyridine-2,6-diamine
    • Inchi: 1S/C17H15N3/c1-3-8-14(9-4-1)18-16-12-7-13-17(20-16)19-15-10-5-2-6-11-15/h1-13H,(H2,18,19,20)
    • InChI Key: VTANJBBCJPIRSD-UHFFFAOYSA-N
    • SMILES: N(C1C=CC=CC=1)C1C=CC=C(N=1)NC1C=CC=CC=1

Computed Properties

  • Exact Mass: 261.12675
  • Monoisotopic Mass: 261.127
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 20
  • Rotatable Bond Count: 4
  • Complexity: 243
  • 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: 4.6
  • Topological Polar Surface Area: 37?2

Experimental Properties

  • PSA: 36.95
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