Isopropanol → Benzyl 3-hydroxy-4-[(pyridin-4-ylamino)methyl]piperidine-1-carboxylate

반응식

[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][C:9](=[O:10])[N:11]1[CH2:12][CH:13]([OH:19])[CH:14]([CH2:17][NH2:18])[CH2:15][CH2:16]1.[CH:27]([OH:28])([CH3:29])[CH3:30].[Cl:20][c:21]1[cH:22][cH:23][n:24][cH:25][cH:26]1>>[CH2:1]([c:2]1[cH:3][cH:4][cH:5][cH:6][cH:7]1)[O:8][C:9](=[O:10])[N:11]1[CH2:12][CH:13]([OH:19])[CH:14]([CH2:17][NH:18][c:21]2[cH:22][cH:23][n:24][cH:25][cH:26]2)[CH2:15][CH2:16]1

참가 물질

반응물 3

HCID 3776Isopropanol

HCID 122884-Chloropyridine

HCID 23577271Benzyl 4-(aminomethyl)-3-hydroxypiperidine-1-carboxylate

생성물 1

HCID 23577273Benzyl 3-hydroxy-4-[(pyridin-4-ylamino)methyl]piperidine-1-carboxylate

출처 및 근거

ORD 기록: ord-e718ff51c07e49a8a88305acccda165b
출처 데이터셋: Training data from https://doi.org/10.1039/C8SC04228D (7/10)
DOI: 10.1039/C8SC04228D

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