HuagongsheHuagongshe Chemistry Print Report · For research reference only
HRID 913337Generated: October 30, 2026
6-Chloronicotinic acid → 4-[(6-Chloro-pyridine-3-carbonyl)-amino]-4-cyano-piperidine-1-carboxylic acid tert-butyl ester
https://huagongshe.com/reaction/913337
Participants
| Role | Name | HCID | Charge |
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| Reactant | 6-Chloronicotinic acid | HCID 79222 | — |
| Reactant | Benzotriazol-1-yloxy-tris(dimethylamino)phosphonium hexafluorophosphate | HCID 151348 | — |
| Reactant | tert-Butyl 4-amino-4-cyanopiperidine-1-carboxylate | HCID 22091429 | — |
| Solvent | Tetrahydrofuran | HCID 8028 | — |
| Solvent | Diisopropylethylamine | HCID 81531 | — |
| Product | 4-[(6-Chloro-pyridine-3-carbonyl)-amino]-4-cyano-piperidine-1-carboxylic acid tert-butyl ester | HCID 86625016 | 74% |
Reaction Steps
To a solution of 4-amino-4-cyano-piperidine-1-carboxylic acid tert-butyl ester (0.527 g, 2.34 mmol, 1.0 equiv; prepared as described in WO 03/104 236 A1 (Bristol-Myers Squibb Company); [CAS RN 331281-25-5]) in anhydrous THF (12 mL) and N-ethyl diisopropylamine (0.48 mL) was added in the presence of (benzotriazol-1-yloxy)-tris-(dimethylamino)phosphonium hexafluorophosphate (1.138 g, 2.58 mmol, 1.1 equiv; BOP reagent) 6-chloro-nicotinic acid (0.369 g, 2.34 mmol, 1.0 equiv) and the reaction mixture stirred at rt for 12 h. The reaction mixture was poured on crashed ice/NH4Cl, extracted with ethyl acetate (2×200 mL) and the combined organic phases washed with a sat. solution of NaCl (2×100 mL) and water (2×100 mL). The organic phase was dried over Na2SO4, concentrated by evaporation under reduced pressure and the crude material purified by silica column chromatography eluting with a mixture of ethyl acetate/triethylamine (97:3) providing 0.63 g (74%) of the title compound as off-white solid. MS (ISP): 365.1 [M+H]+
Provenance & Evidence
| DOI | 10.6084/m9.figshare.5104873.v1 |
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| Patent number | US08026365B2 |
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| Source dataset | uspto-grants-2011_09 |
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| ORD ID | ord-bb85cba21d9044e69a0a732942fb99a8 |
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| Source note | uspto-grants-2011_09 |
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