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

HRID 284291Notes

Reaction equation

HRID 284291 reaction equation
[CH3:35][CH2:36][OH:37].[CH:31]1([NH2:34])[CH2:32][CH2:33]1.[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:34][CH:31]2[CH2:32][CH2:33]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 69828CyclopropylamineHCID 58116540{3-(3-Chloro-1,2,4-oxadiazol-5-yl)-5-[4-(trifluoromethyl)phenyl]piperidin-1-yl}(morpholin-4-yl)methanone

Product 1

HCID 49819289{3-[3-(Cyclopropylamino)-1,2,4-oxadiazol-5-yl]-5-[4-(trifluoromethyl)phenyl]piperidin-1-yl}-(morpholin-4-yl)methanone

Sources & evidence

ORD record
ord-efb92ce0df72489f9dfd16858ad529b4
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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