HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 572020Generated: October 29, 2026
Diisopropylethylamine → trans-(4-Cyclobutylpiperazin-1-yl)-[2-(6-(trifluoromethyl)pyridin-3-yl)cyclopropyl]methanone
https://huagongshe.com/reaction/572020
Participants
| Role | Name | HCID | Charge |
|---|
| Reactant | Diisopropylethylamine | HCID 81531 | — |
| Reactant | O-(Benzotriazol-1-yl)-N,N,N',N'-tetramethyluronium tetrafluoroborate | HCID 2733207 | — |
| Reactant | 1-Cyclobutylpiperazine dihydrochloride | HCID 45156799 | — |
| Reactant | trans-2-[6-(Trifluoromethyl)pyridin-3-yl]cyclopropanecarboxylic acid | HCID 66689840 | — |
| Solvent | Dimethylformamide | HCID 6228 | — |
| Solvent | Ethyl acetate hexane | HCID 21226206 | — |
| Product | trans-(4-Cyclobutylpiperazin-1-yl)-[2-(6-(trifluoromethyl)pyridin-3-yl)cyclopropyl]methanone | HCID 25196792 | 36% |
Reaction Steps
To a stirring solution of 26C (16 mg, 0.070 mmol) in DMF (0.5 mL) at ambient temperature was added DIPEA (0.050 mL, 0.28 mmol) and TBTU (23 mg, 0.070 mmol). After stirring for 2 min, 4A (16 mg, 0.08 mmol) was added in one portion. After stirring for 19 h, the reaction was concentrated under reduced pressure. The residue was diluted with EtOAc (15 mL) then washed successively with dilute aq. K2CO3 (5 mL), H2O (2 mL), and brine (3 mL), dried over Na2SO4, filtered, and concentrated in vacuo. The resulting residue was subjected to flash chromatography (basic alumina-8 g; gradient elution: 5% EtOAc/Hexane for 1 min then 5-100% EtOAc/Hexane over 13 min at 18 mL/min) to afford 8.7 mg 26D (36% yield). m/z (ES+) M+1=285.2; HPLC tR=0.75 min. 1H NMR (500 MHz, CDCl3) δ 8.53 (dd, J=2.1, 0.6 Hz, 1H), 7.59 (d, J=8.2 Hz, 1H), 7.55 (dd, J=8.2, 2.1 Hz, 1H), 3.69-3.59 (m, 4H), 2.74 (quintet, J=7.9 Hz, 1H), 2.60 (ddd, J=9.0, 6.3, 4.0 Hz, 1H), 2.36-2.29 (m, 4H), 2.05 (m, 3H), 1.93-1.82 (m, 2H), 1.79-1.66 (m, 3H), 1.35 (ddd, J=8.7, 6.3, 4.6 Hz, 1H).
Provenance & Evidence
| DOI | 10.6084/m9.figshare.5104873.v1 |
|---|
| Patent number | US09029381B2 |
|---|
| Source dataset | uspto-grants-2015_05 |
|---|
| ORD ID | ord-7fd20183032a4f4eb4435d7d2b384c7c |
|---|
| Source note | uspto-grants-2015_05 |
|---|