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Substance Name: Gabapentin [USAN:USP:INN:BAN]
RN: 60142-96-3
UNII: 6CW7F3G59X
InChIKey: UGJMXCAKCUNAIE-UHFFFAOYSA-N

Note

  • Can be viewed as a cyclohexane-GABA; an oral medication for add-on therapy in the treatment of partial seizures in adult epilepsy; inhibits dopamine release from rabbit caudate nucleus.

Molecular Formula

  • C9-H17-N-O2

Molecular Weight

  • 171.2383
 

Classification Codes

  • Analgesics
  • Anti-Anxiety Agents
  • Anti-Dyskinesia Agents
  • Anticonvulsant
  • Anticonvulsants
  • Antimanic Agents
  • Antiparkinson Agents
  • Calcium Channel Blockers
  • Cardiovascular Agents
  • Central Nervous System Agents
  • Central Nervous System Depressants
  • Drug / Therapeutic Agent
  • Excitatory Amino Acid Agents
  • Excitatory Amino Acid Antagonists
  • Membrane Transport Modulators
  • Neurotransmitter Agents
  • Peripheral Nervous System Agents
  • Psychotropic Drugs
  • Sensory System Agents
  • Tranquilizing Agents

Names and Synonyms

Name of Substance

  • Gabapentin
  • Gabapentin [USAN:USP:INN:BAN]

Synonyms

  • 1-(Aminomethyl)cyclohexaneacetic acid
  • Aclonium
  • BRN 2359739
  • CCRIS 7210
  • CI 945
  • CI-945
  • DM-1796
  • DM-5689
  • EINECS 262-076-3
  • Fanatrex
  • Gabapentin
  • Gabapentine
  • Gabapentine [INN-French]
  • Gabapentino
  • Gabapentino [INN-Spanish]
  • Gabapentino [Spanish]
  • Gabapentinum
  • Gabapentinum [INN-Latin]
  • Gabapetin
  • Go 3450
  • GOE 2450
  • GOE 3450
  • Gralise
  • HSDB 7364
  • Neuontin
  • Neurontin
  • Sefelsa
  • Serada
  • Therapentin-90
  • UNII-6CW7F3G59X
  • Vultin

Systematic Names

  • Cyclohexaneacetic acid, 1-(aminomethyl)-
  • Gabapentin

Registry Numbers

CAS Registry Number

  • 60142-96-3

FDA UNII

  • 6CW7F3G59X

System Generated Number

  • 0060142963

Structure Descriptors

InChI

1S/C9H17NO2/c10-7-9(6-8(11)12)4-2-1-3-5-9/h1-7,10H2,(H,11,12)

InChIKey

UGJMXCAKCUNAIE-UHFFFAOYSA-N

Smiles

C1CCC(CC1)(CC(=O)O)CN

Toxicity

Organism Test Type Route Reported Dose (Normalized Dose) Effect Source
mouse LD intravenous > 1gm/kg (1000mg/kg)   Drugs of the Future. Vol. 11, Pg. 518, 1986.
mouse LD oral > 8053mg/kg (8053mg/kg)   Drugs of the Future. Vol. 9, Pg. 418, 1984.
rat LD intravenous > 2gm/kg (2000mg/kg)   Drugs of the Future. Vol. 11, Pg. 518, 1986.
rat LD oral > 8gm/kg (8000mg/kg)   Drugs of the Future. Vol. 11, Pg. 518, 1986.

Physical Properties

Physical Property Value Units Temp (deg C) Source
log P (octanol-water) -1.10E+00 (none)   EXP
Water Solubility 4490 mg/L 25 EST
Vapor Pressure 2.94E-10 mm Hg 25 EST
Henry's Law Constant 1.81E-10 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 4.01E-11 cm3/molecule-sec 25 EST

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