1-Pyrrolidineethanamine → 4-[3-(2-Pyrrolidin-1-yl-ethylamino)-phenyl]-piperazine-1-carboxylic acid tert-butyl ester
Reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH2:10][N:11]([c:14]2[cH:15][c:16]([Br:20])[cH:17][cH:18][cH:19]2)[CH2:12][CH2:13]1.[N:21]1([CH2:26][CH2:27][NH2:28])[CH2:22][CH2:23][CH2:24][CH2:25]1.[O:29]1[CH2:30][CH2:31][O:32][CH2:33][CH2:34]1.[O:37]=[C:38]([CH:39]=[CH:40][c:41]1[cH:42][cH:43][cH:44][cH:45][cH:46]1)[CH:47]=[CH:48][c:49]1[cH:50][cH:51][cH:52][cH:53][cH:54]1.[O:55]=[C:56]([CH:57]=[CH:58][c:59]1[cH:60][cH:61][cH:62][cH:63][cH:64]1)[CH:65]=[CH:66][c:67]1[cH:68][cH:69][cH:70][cH:71][cH:72]1.[O:73]=[C:74]([CH:75]=[CH:76][c:77]1[cH:78][cH:79][cH:80][cH:81][cH:82]1)[CH:83]=[CH:84][c:85]1[cH:86][cH:87][cH:88][cH:89][cH:90]1.[Pd:35].[Pd:36]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[N:8]1[CH2:9][CH2:10][N:11]([c:14]2[cH:15][c:16]([NH:28][CH2:27][CH2:26][N:21]3[CH2:22][CH2:23][CH2:24][CH2:25]3)[cH:17][cH:18][cH:19]2)[CH2:12][CH2:13]1Participants
6
Sources & evidence
- ORD record
- ord-25975d5684454bd9be82a1c4335484a9
- Source dataset
- Training data from https://doi.org/10.1039/C8SC04228D (5/10)
Reaction notes
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