Cas no 78070-05-0 (N~4~-(pyridin-4-ylmethyl)pyridine-3,4-diamine)

N~4~-(pyridin-4-ylmethyl)pyridine-3,4-diamine structure
78070-05-0 structure
Product Name:N~4~-(pyridin-4-ylmethyl)pyridine-3,4-diamine
CAS No:78070-05-0
MF:C11H12N4
MW:200.2397813797
CID:1790689
PubChem ID:3060376
Update Time:2025-04-21

N~4~-(pyridin-4-ylmethyl)pyridine-3,4-diamine Chemical and Physical Properties

Names and Identifiers

    • N~4~-(pyridin-4-ylmethyl)pyridine-3,4-diamine
    • 3-N-(pyridin-4-ylmethyl)pyridine-3,4-diamine
    • 4-{[(Pyridin-4-yl)methyl]imino}-1,4-dihydropyridin-3-amine
    • DTXSID40999308
    • 3,4-Pyridinediamine, N(sup 4)-(4-pyridinylmethyl)-, dihydrochloride
    • Pyridine, 3-amino-4-((4-pyridylmethyl)amino)-, dihydrochloride
    • 78070-05-0
    • Inchi: 1S/C11H12N4/c12-10-8-14-6-3-11(10)15-7-9-1-4-13-5-2-9/h1-6,8H,7,12H2,(H,14,15)
    • InChI Key: GIMWYWKTDWPTNX-UHFFFAOYSA-N
    • SMILES: N(C1C=CN=CC=1N)CC1C=CN=CC=1

Computed Properties

  • Exact Mass: 200.10636
  • Monoisotopic Mass: 200.106196400g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 15
  • Rotatable Bond Count: 3
  • Complexity: 179
  • 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: 0.6
  • Topological Polar Surface Area: 63.8?2

Experimental Properties

  • PSA: 63.83
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