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Substance Name: Cyclopropanecarboxamide, 2-(aminomethyl)-N,N-dibutyl-1-phenyl-, (Z)-, oxalate
RN: 105310-43-8
InChIKey: KSKVOYHVTYRAHL-ZFNKBKEPSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C19-H30-N2-O.C2-H2-O4

Molecular Weight

  • 392.493
 
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Names and Synonyms

Synonym

  • (Z)-2-(Aminomethyl)-N,N-dibutyl-1-phenylcyclopropanecarboxamide oxalate

Systematic Name

  • Cyclopropanecarboxamide, 2-(aminomethyl)-N,N-dibutyl-1-phenyl-, (Z)-, oxalate

Registry Numbers

CAS Registry Number

  • 105310-43-8

System Generated Number

  • 0105310438

Molecular Formulas

Molecular Formula

  • C19-H30-N2-O.C2-H2-O4

Molecular Formula Fragments

  • C19-H30-N2-O
  • C2-H2-O4
  • COMPONENT

Structure Descriptors

InChI

1S/C19H30N2O.C2H2O4/c1-3-5-12-21(13-6-4-2)18(22)19(14-17(19)15-20)16-10-8-7-9-11-16;3-1(4)2(5)6/h7-11,17H,3-6,12-15,20H2,1-2H3;(H,3,4)(H,5,6)/t17-,19+;/m1./s1

InChIKey

KSKVOYHVTYRAHL-ZFNKBKEPSA-N

Smiles

c1([C@@]2([C@H](C2)C[NH3+])C(=O)N(CCCC)CCCC)ccccc1.C(C(=O)[O-])(O)=O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 oral 562mg/kg (562mg/kg)   Journal of Medicinal Chemistry. Vol. 30, Pg. 318, 1987.