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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 1919342Generated: October 31, 2026

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

https://huagongshe.com/reaction/1919342

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 numberUS08168623B2
Source datasetuspto-grants-2012_05
ORD IDord-7bc47aa755494cb9bd4b3804c1a63860
Source noteuspto-grants-2012_05