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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 400531Generated: November 1, 2026

1-Ethyl-3-(3'-dimethylaminopropyl)carbodiimide → HCID 46852902, compound

https://huagongshe.com/reaction/400531

Reaction equation

Participants

RoleNameHCIDCharge
Reactant1-Ethyl-3-(3'-dimethylaminopropyl)carbodiimideHCID 15908—
Reactant1-Hydroxybenzotriazole hydrateHCID 2796029—
Reactant(8aR)-Octahydropyrrolo(1,2-a)pyrazineHCID 7004239—
ReactantHCID 66676232HCID 66676232—
SolventDichloromethaneHCID 6344—
Solventdichloromethane N,N-dimethylformamideHCID 22350042—
ProductHCID 46852902HCID 46852902—

Reaction Steps

To a mixture of 3-(N-isopropyl-3-(trifluoromethyl)phenylsulfonamido)benzoic acid (155 mg, 0.4 mmol) and 1-hydroxybenzotriazole hydrate (61 mg, 0.4 mmol) in dichloromethane/N,N-dimethylformamide (4:1, 6 mL) was added 1-(3-dimethylaminopropyl)-3-ethylcarbodiimide (EDC, 62 mg, 0.4 mmol) in dichloromethane (1 mL). After 5 minutes, (R)-octahydropyrrolo[1,2-a]pyrazine (50 mg, 0.4 mmol) in dichloromethane (1 mL) was added. The mixture was stirred at room temperature overnight. Then the mixture was concentrated. The residue was diluted with ethyl acetate (100 mL), washed with water (2×20 mL), dried over sodium sulfate, and concentrated. The residue was purified by chromatography on silica gel (dichloromethane, then methanol/dichloromethane=1:12) to give the titled compound: 1H NMR (300 MHz, DMSO-d6) δ ppm 1.00 (d, 6H, J=8 Hz), 1.35 (m, 1H), 1.65-2.10 (m, 6H), 2.80-3.05 (m, 4H), 3.45-3.55 (m, 1H), 4.40-4.50 (m, 1H), 4.60 (m, 1H), 6.98 (s, 1H), 7.15 (m, 1H), 7.50 (m, 2H), 7.88 (m, 2H), 8.10 (m, 2H); MS (ESI) m/z 496 (M+H)+.

Provenance & Evidence

DOI10.6084/m9.figshare.5104873.v1
Patent numberUS08741899B2
Source datasetuspto-grants-2014_06
ORD IDord-41571eec2a8841e08cb570573593d929
Source noteuspto-grants-2014_06