Methanol → 4-[1-(2-Amino-ethyl)-4-(3-chloro-4-fluoro-phenyl)-1H-imidazol-2-yl]-piperidine-1-carboxylic acid tert-butyl ester

HRID 88979Notes

Reaction equation

HRID 88979 reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH2:10][CH:11]([c:14]2[n:15]([CH2:27][C:28]#[N:29])[cH:16][c:17](-[c:19]3[cH:20][c:21]([Cl:26])[c:22]([F:25])[cH:23][cH:24]3)[n:18]2)[CH2:12][CH2:13]1.[CH3:30][OH:31].[Cl:32][Ni:33][Cl:34]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH2:10][CH:11]([c:14]2[n:15]([CH2:27][CH2:28][NH2:29])[cH:16][c:17](-[c:19]3[cH:20][c:21]([Cl:26])[c:22]([F:25])[cH:23][cH:24]3)[n:18]2)[CH2:12][CH2:13]1

Participants

4

Reactant 3

HCID 887MethanolHCID 24385Nickel DichlorideHCID 672655344-[4-(3-Chloro-4-fluoro-phenyl)-1-cyanomethyl-1H-imidazol-2-yl]-piperidine-1-carboxylic acid tert-butyl ester

Product 1

HCID 672651144-[1-(2-Amino-ethyl)-4-(3-chloro-4-fluoro-phenyl)-1H-imidazol-2-yl]-piperidine-1-carboxylic acid tert-butyl ester

Sources & evidence

ORD record
ord-5c348e47cd5f4552b596f1509d808c40
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (2/10)

Reaction notes

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