Acetonitrile → 2-cyclopropyl-N-[1-(4-hydroxy-4-phenylpiperidin-1-yl)-3,3-dimethyl-1-oxobutan-2-yl]-5H-pyrrolo[2,3-b]pyrazine-7-carboxamide

HRID 298204Notes

Reaction equation

HRID 298204 reaction equation
[CH3:64][C:65]#[N:66].[Cs+:63].[F-:62].[O:44]1[CH2:45][CH2:46][O:47][CH2:48][CH2:49][O:50][CH2:51][CH2:52][O:53][CH2:54][CH2:55][O:56][CH2:57][CH2:58][O:59][CH2:60][CH2:61]1.[OH:1][C:2]1([c:38]2[cH:39][cH:40][cH:41][cH:42][cH:43]2)[CH2:3][CH2:4][N:5]([C:8](=[O:9])[CH:10]([C:11]([CH3:12])([CH3:13])[CH3:14])[NH:15][C:16](=[O:17])[c:18]2[cH:19][n:20]([CH2:30][O:31][CH2:32][CH2:33][Si:34]([CH3:35])([CH3:36])[CH3:37])[c:21]3[n:22][cH:23][c:24]([CH:27]4[CH2:28][CH2:29]4)[n:25][c:26]23)[CH2:6][CH2:7]1>>[OH:1][C:2]1([c:38]2[cH:39][cH:40][cH:41][cH:42][cH:43]2)[CH2:3][CH2:4][N:5]([C:8](=[O:9])[CH:10]([C:11]([CH3:12])([CH3:13])[CH3:14])[NH:15][C:16](=[O:17])[c:18]2[cH:19][nH:20][c:21]3[n:22][cH:23][c:24]([CH:27]4[CH2:28][CH2:29]4)[n:25][c:26]23)[CH2:6][CH2:7]1

Participants

6

Reactant 5

HCID 6342AcetonitrileHCID 28179Fluoride IonHCID 2855718-Crown-6HCID 104967Cesium cationHCID 178446497HCID 178446497, compound

Product 1

HCID 760313212-cyclopropyl-N-[1-(4-hydroxy-4-phenylpiperidin-1-yl)-3,3-dimethyl-1-oxobutan-2-yl]-5H-pyrrolo[2,3-b]pyrazine-7-carboxamide

Sources & evidence

ORD record
ord-f032e1e3d50544e1a90af53a12b74042
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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