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Substance Name: Quinoline, 2-(3-(dimethylamino)propoxy)-4-phenyl-, hydrochloride, hydrate
RN: 97633-97-1
InChIKey: XNACDEYRMQAQNI-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C20-H22-N2-O.Cl-H.H2-O

Molecular Weight

  • 360.8825
 
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Names and Synonyms

Synonyms

  • 2-(3-(Dimethylamino)propoxy)-4-phenylquinoline hydrochloride hydrate
  • 4-Phenyl-2-(3-(dimethylamino)propoxy)quinoline hydrochloride hydrate

Systematic Name

  • Quinoline, 2-(3-(dimethylamino)propoxy)-4-phenyl-, hydrochloride, hydrate

Registry Numbers

CAS Registry Number

  • 97633-97-1

System Generated Number

  • 0097633971

Molecular Formulas

Molecular Formula

  • C20-H22-N2-O.Cl-H.H2-O

Molecular Formula Fragments

  • C20-H22-N2-O
  • Cl-H
  • COMPONENT
  • H2-O

Structure Descriptors

InChI

1S/C20H22N2O.ClH.H2O/c1-22(2)13-8-14-23-20-15-18(16-9-4-3-5-10-16)17-11-6-7-12-19(17)21-20;;/h3-7,9-12,15H,8,13-14H2,1-2H3;1H;1H2

InChIKey

XNACDEYRMQAQNI-UHFFFAOYSA-N

Smiles

n1c2ccccc2c(cc1OCCCN(C)C)c1ccccc1.Cl.O

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 200mg/kg (200mg/kg)   Journal of Medicinal Chemistry. Vol. 28, Pg. 1394, 1985.