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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 1184374Generated: November 1, 2026

Water → HCID 49783842, compound

https://huagongshe.com/reaction/1184374

Reaction equation

Participants

RoleNameHCIDCharge
ReactantWaterHCID 962—
ReactantEthyl AcetateHCID 8857—
ReactantN,N-Dimethylpiperidin-4-amineHCID 417391—
ReactantHCID 59548934HCID 59548934—
SolventDichloromethaneHCID 6344—
ProductHCID 49783842HCID 4978384256%

Reaction Steps

To a solution of compound 29 (0.100 g, 0.26 mmol) in DCM (8.00 mL) was added 4-dimethylaminopiperidine (0.044 g, 0.34 mmol) and TEA (0.034 g, 0.34 mmol). The reaction was monitored with TLC (25% EtOAc in hexanes, Rf=0.0). After stirring at room temperature for 2 hrs, the reaction was complete as indicated by the absence of the starting material (TLC). Water was added and aqueous layer was extracted twice with DCM. Combined extracts were washed sequentially with water and brine, dried over MgSO4, filtered, and evaporated in vacuo to form a clear oil. The oil was dissolved in DCM and purified with chromatography with a gradient from 0 to 30% MeOH in DCM. Pure fractions were combined, evaporated in vacuo, triturated with DCM and hexanes, and then filtered to yield compound 83 as a white powder (0.068 g, 100% HPLC purity, 56% yield). 1H NMR (500 MHz, DMSO-d6): δ 8.26 (d, J=2 Hz, 1H), 7.89 (m, 2H), 7.78 (d, J=9 Hz, 1H), 7.71 (dd, J1=3 Hz, J2=9 Hz, 1H), 6.93 (d, J=8 Hz, 1H), 3.79 (d, J=12 Hz, 2H), 2.85 (t, J=13 Hz, 2H), 2.22 (m, 1H), 2.12 (s, 6H), 1.79 (m, 2H), 1.40 (m, 2H); MS (ESI, EI+): m/z=470 (MH+); melting point: 140-143° C.

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS08669247B2
Source datasetuspto-grants-2014_03
ORD IDord-71f198988ace4027957c0be7e4fea23e
Source noteuspto-grants-2014_03