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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 1710437Generated: October 27, 2026

Gabapentin → Piperidinium 1-{(1-Methyl-2-(Ethoxycarbonyl)-3-Ethoxy-3-Oxoprop-1-enyl)aminomethyl}-1-C yclohexane Acetate

https://huagongshe.com/reaction/1710437

Reaction equation

Participants

RoleNameHCIDCharge
ReactantGabapentinHCID 3446—
ReactantPiperidineHCID 8082—
Reactant1,3-Diethyl 2-acetylpropanedioateHCID 136365—
SolventEthanolHCID 702—
ProductPiperidinium 1-{(1-Methyl-2-(Ethoxycarbonyl)-3-Ethoxy-3-Oxoprop-1-enyl)aminomethyl}-1-C yclohexane AcetateHCID 22272000—

Reaction Steps

Diethyl acetylmalonate (202 mg, 1 mmol), gabapentin (171 mg, 1 mmol), and piperidine (99 μL, 1 mmol) were mixed in anhydrous ethanol (10 mL). After heating under reflux for 16 h, the solvent was removed under reduced pressure to give the title compound with purity greater than 90%. 1H NMR (CDCl3, 400 MHz): δ 1.28 (t, J=7.2 Hz, 6H), 1.38-1.64 (m, 12H), 1.75 (m, 4H), 1.96 (s, 3H), 2.23 (s, 2H), 2.99 (m, 4H), 3.24 (d, J=5.2 Hz, 2H), 4.20 (q, J=7.2 Hz, 4H), 4.35 (s, br, 2H), 7.79 (t, J=5.2 Hz, 1H). MS (ESI) m/z 354.38 (M−H−).

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS07790708B2
Source datasetuspto-grants-2010_09
ORD IDord-3e64ba35a8b449058b7540441e7831a0
Source noteuspto-grants-2010_09