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Substance Name: 3-Pyridinecarbonitrile, 2-amino-4-(cyclohexylamino)-
RN: 104802-92-8
InChIKey: XQHDQWVSSVBRDQ-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C12-H16-N4

Molecular Weight

  • 216.2864
 
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Names and Synonyms

Synonyms

  • 2-Amino-4-(cyclohexylamino)-3-pyridinecarbonitrile
  • BRN 5540688
  • Nicotinonitrile, 2-amino-4-(cyclohexylamino)-

Systematic Name

  • 3-Pyridinecarbonitrile, 2-amino-4-(cyclohexylamino)-

Registry Numbers

CAS Registry Number

  • 104802-92-8

System Generated Number

  • 0104802928

Structure Descriptors

InChI

1S/C12H16N4/c13-8-10-11(6-7-15-12(10)14)16-9-4-2-1-3-5-9/h6-7,9H,1-5H2,(H3,14,15,16)

InChIKey

XQHDQWVSSVBRDQ-UHFFFAOYSA-N

Smiles

c1cnc(c(c1NC2CCCCC2)C#N)N

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 355mg/kg (355mg/kg)   Pharmaceutical Chemistry Journal Vol. 20, Pg. 483, 1986.