Acetate → 4-[4-Amino-3-(4,4-dimethyl-cyclohex-1-enyl)-phenyl]-piperidine-2,6-dione

HRID 1124622Notes

Reaction equation

HRID 1124622 reaction equation
[CH3:25][C:26]1([CH3:35])[CH2:27][CH:28]=[C:29]([B:32]([OH:33])[OH:34])[CH2:30][CH2:31]1.[CH3:61][c:62]1[cH:63][cH:64][cH:65][cH:66][cH:67]1.[CH3:74][CH2:75][O:76][C:77]([CH3:78])=[O:79].[CH:36]1([P:37]([CH:38]2[CH2:39][CH2:40][CH2:41][CH2:42][CH2:43]2)[c:44]2[cH:45][cH:46][cH:47][cH:48][c:49]2-[c:50]2[cH:51][cH:52][cH:53][cH:54][cH:55]2)[CH2:56][CH2:57][CH2:58][CH2:59][CH2:60]1.[K+:22].[K+:23].[K+:24].[NH2:1][c:2]1[c:3]([Br:16])[cH:4][c:5]([CH:8]2[CH2:9][C:10](=[O:15])[NH:11][C:12](=[O:14])[CH2:13]2)[cH:6][cH:7]1.[O-:81][C:82]([CH3:83])=[O:84].[O-:85][C:86]([CH3:87])=[O:88].[O:68]1[CH2:69][CH2:70][O:71][CH2:72][CH2:73]1.[P:17]([O-:18])([O-:19])([O-:20])=[O:21].[Pd+2:80]>>[NH2:1][c:2]1[c:3]([C:29]2=[CH:28][CH2:27][C:26]([CH3:25])([CH3:35])[CH2:31][CH2:30]2)[cH:4][c:5]([CH:8]2[CH2:9][C:10](=[O:15])[NH:11][C:12](=[O:14])[CH2:13]2)[cH:6][cH:7]1

Participants

11

Reactant 10

HCID 175Acetate2×HCID 813Potassium Cation3×HCID 1061PhosphateHCID 1140TolueneHCID 8857Ethyl AcetateHCID 312751,4-DioxaneHCID 105144Allyl(1,3-bis(2,6-diisopropylphenyl)imidazol-2-ylidene)chloropalladium(II)HCID 27342162-(Dicyclohexylphosphino)biphenylHCID 441195554,4-Dimethylcyclohexen-1-ylboronic acidHCID 597712744-(4-Amino-3-bromo-phenyl)-piperidine-2,6-dione

Product 1

HCID 597712924-[4-Amino-3-(4,4-dimethyl-cyclohex-1-enyl)-phenyl]-piperidine-2,6-dione

Sources & evidence

ORD record
ord-4437fc03e03c4cfa956afdb36b195ba7
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (7/10)

Reaction notes

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