Methyl Isobutyl Ketone → N-[1-(1-benzoylethyl)-4-(methoxymethyl)-4-piperidinyl]-N-phenylpropanamide

HRID 669006Notes

Reaction equation

HRID 669006 reaction equation
[Br:1][CH:2]([C:3](=[O:4])[c:5]1[cH:6][cH:7][cH:8][cH:9][cH:10]1)[CH3:11].[CH3:12][O:13][CH2:14][C:15]1([N:21]([C:22]([CH2:23][CH3:24])=[O:25])[c:26]2[cH:27][cH:28][cH:29][cH:30][cH:31]2)[CH2:16][CH2:17][NH:18][CH2:19][CH2:20]1.[CH3:32][CH:33]([NH:34][CH:35]([CH3:36])[CH3:37])[CH3:38].[CH3:39][CH:40]([CH3:41])[CH2:42][C:43](=[O:44])[CH3:45]>>[CH:2]([C:3](=[O:4])[c:5]1[cH:6][cH:7][cH:8][cH:9][cH:10]1)([CH3:11])[N:18]1[CH2:17][CH2:16][C:15]([CH2:14][O:13][CH3:12])([N:21]([C:22]([CH2:23][CH3:24])=[O:25])[c:26]2[cH:27][cH:28][cH:29][cH:30][cH:31]2)[CH2:20][CH2:19]1

Participants

5

Reactant 4

HCID 7909Methyl Isobutyl KetoneHCID 7912DiisopropylamineHCID 164522-BromopropiophenoneHCID 162172Noralfentanil

Product 1

HCID 12298105N-[1-(1-benzoylethyl)-4-(methoxymethyl)-4-piperidinyl]-N-phenylpropanamide

Sources & evidence

ORD record
ord-a8856fb9df87444aa058ad24e726c7e4
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (3/10)

Reaction notes

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