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Substance Name: 1-Piperidineacetanilide
RN: 4671-97-0
InChIKey: WFECYQKJNWJCBA-UHFFFAOYSA-N

Classification Code

  • Drug / Therapeutic Agent

Molecular Formula

  • C13-H18-N2-O

Molecular Weight

  • 218.298
 
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Names and Synonyms

Synonyms

  • 1-Piperidineacetamide, N-phenyl-
  • 2-Piperidinoacetanilide
  • 5-20-03-00008 (Beilstein Handbook Reference)
  • BRN 0165482
  • DG 1
  • IEM-189
  • Piperidinoacetanilide

Systematic Name

  • 1-Piperidineacetanilide

Registry Numbers

CAS Registry Number

  • 4671-97-0

System Generated Number

  • 0004671970

Structure Descriptors

InChI

1S/C13H18N2O/c16-13(11-15-9-5-2-6-10-15)14-12-7-3-1-4-8-12/h1,3-4,7-8H,2,5-6,9-11H2,(H,14,16)

InChIKey

WFECYQKJNWJCBA-UHFFFAOYSA-N

Smiles

c1ccccc1NC(=O)CN1CCCCC1

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD50 intraperitoneal 530mg/kg (530mg/kg) BEHAVIORAL: TREMOR

BEHAVIORAL: CONVULSIONS OR EFFECT ON SEIZURE THRESHOLD

BEHAVIORAL: REGIDITY
Neuropharmacology. Vol. 12, Pg. 101, 1973.
mouse LD50 subcutaneous 380mg/kg (380mg/kg) BEHAVIORAL: MUSCLE CONTRACTION OR SPASTICITY) Farmakologiya i Toksikologiya Vol. 24, Pg. 40, 1961.

Physical Properties

Physical Property Value Units Temp (deg C) Source
log P (octanol-water) 2.71 (none)   EXP
Water Solubility 170 mg/L 25 EST
Vapor Pressure 1.05E-06 mm Hg 25 EST
Henry's Law Constant 6.30E-11 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 1.11E-10 cm3/molecule-sec 25 EST

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