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Substance Name: Thenyldiamine [INN:BAN]
RN: 91-79-2
UNII: E4U52363JE
InChIKey: RCGYDFVCAAKKNG-UHFFFAOYSA-N

Classification Codes

  • Drug / Therapeutic Agent
  • Human Data
  • Mutation Data

Molecular Formula

  • C14-H19-N3-S

Molecular Weight

  • 261.3911
 
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Names and Synonyms

Name of Substance

  • Thenyldiamine
  • Thenyldiamine [INN:BAN]

Synonyms

  • 1,2-Ethanediamine, N,N-dimethyl-N'-2-pyridinyl-N'-(3-thienylmethyl)-
  • 2-((2-(Dimethylamino)ethyl)-3-thenylamino)pyridine
  • 2-((2-Dimethylaminoethyl)-3-thenylamino)pyridine
  • 4-22-00-03953 (Beilstein Handbook Reference)
  • BRN 0221267
  • EINECS 202-098-2
  • HSDB 5190
  • N,N-Dimethyl-N'-(alpha-pyridyl)-N'-(3-methylthienyl)ethylenediamine
  • N,N-Dimethyl-N'-2-pyridinyl-N'-(3-thienylmethyl)-1,2-ethanediamine
  • N-(2-Dimethylaminoethyl)-N-2-pyridyl-3-thenylamine
  • N-(alpha-Pyridyl)-N-(beta-thenyl)-N',N'-dimethylethylenediamine
  • NCI-C60640
  • Pyridine, 2-((2-(dimethylamino)ethyl)-3-thenylamino)-
  • Tenfidil
  • Tenildiamina
  • Tenildiamina [INN-Spanish]
  • Thefanil
  • Thenfadil
  • Thenyldiamine
  • Thenyldiamine (pharmaceutical)
  • Thenyldiaminum
  • Thenyldiaminum [INN-Latin]
  • UNII-E4U52363JE
  • WIN-2848

Systematic Names

  • 2-((2-(Dimethylamino)ethyl)-3-thenylamino)pyridine
  • Pyridine, 2-((2-(dimethylamino)ethyl)-3-thenylamino)-
  • Thenyldiamine

Registry Numbers

CAS Registry Number

  • 91-79-2

FDA UNII

  • E4U52363JE

System Generated Number

  • 0000091792

Structure Descriptors

InChI

1S/C14H19N3S/c1-16(2)8-9-17(11-13-6-10-18-12-13)14-5-3-4-7-15-14/h3-7,10,12H,8-9,11H2,1-2H3

InChIKey

RCGYDFVCAAKKNG-UHFFFAOYSA-N

Smiles

CN(C)CCN(Cc1ccsc1)c2ccccn2

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
human TDLo oral 50mg/kg (50mg/kg) BEHAVIORAL: "HALLUCINATIONS, DISTORTED PERCEPTIONS"

GASTROINTESTINAL: OTHER CHANGES
Clinical Toxicology. Vol. 11, Pg. 287, 1977.
mouse LD50 intraperitoneal 77mg/kg (77mg/kg)   Compilation of LD50 Values of New Drugs.

Physical Properties

Physical Property Value Units Temp (deg C) Source
log P (octanol-water) 2.550 (none)   EST
Water Solubility 4440 mg/L 37 EXP
Atmospheric OH Rate Constant 1.50E-10 cm3/molecule-sec 25 EST

Physical property data is provided to ChemIDplus by SRC, Inc.