Ethanol → (3-{3-[(1-Methylcyclobutyl)amino]-1,2,4-oxadiazol-5-yl}-5-[4-(trifluoromethyl)phenyl]piperidin-1-yl)(morpholin-4-yl)methanone

HRID 702438Notes

Reaction equation

HRID 702438 reaction equation
[CH3:31][C:32]1([NH2:36])[CH2:33][CH2:34][CH2:35]1.[CH3:37][CH2:38][OH:39].[Cl:1][c:2]1[n:3][o:4][c:5]([CH:7]2[CH2:8][N:9]([C:23](=[O:24])[N:25]3[CH2:26][CH2:27][O:28][CH2:29][CH2:30]3)[CH2:10][CH:11]([c:13]3[cH:14][cH:15][c:16]([C:19]([F:20])([F:21])[F:22])[cH:17][cH:18]3)[CH2:12]2)[n:6]1>>[c:2]1([NH:36][C:32]2([CH3:31])[CH2:33][CH2:34][CH2:35]2)[n:3][o:4][c:5]([CH:7]2[CH2:8][N:9]([C:23](=[O:24])[N:25]3[CH2:26][CH2:27][O:28][CH2:29][CH2:30]3)[CH2:10][CH:11]([c:13]3[cH:14][cH:15][c:16]([C:19]([F:20])([F:21])[F:22])[cH:17][cH:18]3)[CH2:12]2)[n:6]1

Participants

4

Reactant 3

HCID 702EthanolHCID 14988399(1-Methylcyclobutyl)amineHCID 58116540{3-(3-Chloro-1,2,4-oxadiazol-5-yl)-5-[4-(trifluoromethyl)phenyl]piperidin-1-yl}(morpholin-4-yl)methanone

Product 1

HCID 49819290(3-{3-[(1-Methylcyclobutyl)amino]-1,2,4-oxadiazol-5-yl}-5-[4-(trifluoromethyl)phenyl]piperidin-1-yl)(morpholin-4-yl)methanone

Sources & evidence

ORD record
ord-7c605ce81a8d450a9943c258d1445860
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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