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Triethylamine → 1-(3-(10,11-Dihydro-5H-dibenz[b,f]azepin-5-yl)-1-propyl)-3-piperidinecarboxamide hydrochloride

HRID 1166413
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HRID 1166413 반응식
[CH:1]1[C:11]2[CH2:10][CH2:9][C:8]3[CH:12]=[CH:13][CH:14]=[CH:15][C:7]=3[N:6]([CH2:16][CH2:17][CH2:18]O)[C:5]=2[CH:4]=[CH:3][CH:2]=1.C(N(CC)CC)C.CS([Cl:31])(=O)=O.[NH:32]1[CH2:37][CH2:36][CH2:35][CH:34]([C:38]([NH2:40])=[O:39])[CH2:33]1.C(=O)([O-])[O-].[K+].[K+]>C1(C)C=CC=CC=1.O>[ClH:31].[CH:1]1[C:11]2[CH2:10][CH2:9][C:8]3[CH:12]=[CH:13][CH:14]=[CH:15][C:7]=3[N:6]([CH2:16][CH2:17][CH2:18][N:32]3[CH2:37][CH2:36][CH2:35][CH:34]([C:38]([NH2:40])=[O:39])[CH2:33]3)[C:5]=2[CH:4]=[CH:3][CH:2]=1
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참가 물질

8

반응물 5

HCID 8471TriethylamineHCID 11430Potassium CarbonateHCID 31297Methanesulfonyl chlorideHCID 929803-PiperidinecarboxamideHCID 110214143-(10,11-dihydro-5H-dibenz[b,f]azepin-5-yl)-1-propanol

생성물 1

HCID 98222911-(3-(10,11-Dihydro-5H-dibenz[b,f]azepin-5-yl)-1-propyl)-3-piperidinecarboxamide hydrochloride
수율 64%

시약·촉매·용매 2

HCID 962Water용매2회HCID 1140Toluene용매2회

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온도
0 °C

실험 절차

To a stirred solution of 3-(10,11-dihydro-5H-dibenz[b,f]azepin-5-yl)-1-propanol (1.44 g, 0.0057 mol, prepared similarly as described in example 2) and triethylamine (1.46 g, 0.014 mol) in toluene (40 ml) at 0° C., methanesulfonyl chloride (0.88 ml, 0.011 mol) was added dropwise over 10 minutes. The resulting mixture was stirred at 0° C. for 1.5 h. Toluene (50 ml) and water (100 ml) were added, and the phases were separated. The aqueous phase was extracted with toluene (50 ml), and the combined organic phases were washed with brine (2×100 ml), dried (MgSO4) and concentrated in vacuo. The residue was dissolved in acetonitrile (20 ml) and 3-piperidinecarboxamide (1.09 g, 0.0085 mol) and potassium carbonate (1.76 g, 0.013 mol) were added. The mixture was heated at reflux temperature for 4 h, and stirred at room temperature for 40 h. Water (20 ml) was added, and the product was extracted with ethyl acetate (2×20 ml). The combined organic extracts were washed with brine (2×20 ml), dried (MgSO4) and concentrated in vacuo. Water (20 ml) and concentrated hydrochloric acid (3.0 ml) were added, and the mixture was extracted with dichloromethane (2×20 ml), dried (MgSO4) and concentrated in vacuo. The residue was redissolved in a mixture of warm ethyl acetate (10 ml) and methanol (1.0 ml), and after standing for 5 h at room temperature, a precipitate was filtered off and dried, affording 1.56 g (64%) of the title compound.

후처리

  1. customat 0° C.
  2. customthe phases were separated
  3. extractionThe aqueous phase was extracted with toluene (50 ml)
  4. washthe combined organic phases were washed with brine (2×100 ml)
  5. dry with materialdried (MgSO4)
  6. concentrationconcentrated in vacuo
  7. dissolutionThe residue was dissolved in acetonitrile (20 ml)
  8. temperatureThe mixture was heated
  9. temperatureat reflux temperature for 4 h
  10. stirringstirred at room temperature for 40 h
  11. extractionthe product was extracted with ethyl acetate (2×20 ml)
  12. washThe combined organic extracts were washed with brine (2×20 ml)
  13. dry with materialdried (MgSO4)
  14. concentrationconcentrated in vacuo
  15. additionWater (20 ml) and concentrated hydrochloric acid (3.0 ml) were added
  16. extractionthe mixture was extracted with dichloromethane (2×20 ml)
  17. dry with materialdried (MgSO4)
  18. concentrationconcentrated in vacuo
  19. dissolutionThe residue was redissolved in a mixture of warm ethyl acetate (10 ml) and methanol (1.0 ml)
  20. waitafter standing for 5 h at room temperature
  21. filtrationa precipitate was filtered off
  22. customdried

출처 및 근거

ORD 기록
ord-9ad7e91f00f84f5e9ca1be62bce07904
출처 데이터셋
uspto-grants-2003_09
DOI
10.6084/m9.figshare.5104873.v1
특허 번호
US06613791B1

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