Acetic Acid → Ethyl 1-Boc-3-(1-phenylethylamino)piperidine-4-carboxylate

HRID 1202647Notes

Reaction equation

HRID 1202647 reaction equation
[C:32]([OH:33])(=[O:34])[CH:35]=[CH:36][C:37]([OH:38])=[O:39].[CH3:28][C:29](=[O:30])[OH:31].[CH3:54][c:55]1[cH:56][cH:57][cH:58][cH:59][cH:60]1.[Cl:40][c:41]1[n:42][cH:43][c:44]([N:45]2[CH2:46][CH:47]3[CH:48]2[CH2:49][NH:50][CH2:51]3)[cH:52][cH:53]1.[c:1]1([CH:7]([CH3:8])[NH:9][C:10]2=[C:11]([C:23](=[O:24])[O:25][CH2:26][CH3:27])[CH2:12][CH2:13][N:14]([C:16](=[O:17])[O:18][C:19]([CH3:20])([CH3:21])[CH3:22])[CH2:15]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1>>[c:1]1([CH:7]([CH3:8])[NH:9][CH:10]2[CH:11]([C:23](=[O:24])[O:25][CH2:26][CH3:27])[CH2:12][CH2:13][N:14]([C:16](=[O:17])[O:18][C:19]([CH3:20])([CH3:21])[CH3:22])[CH2:15]2)[cH:2][cH:3][cH:4][cH:5][cH:6]1

Participants

6

Reactant 5

HCID 176Acetic AcidHCID 7232-Butenedioic acidHCID 1140TolueneHCID 98992006-(6-Chloro-3-pyridinyl)-3,6-diazabicyclo[3.2.0]heptaneHCID 235906231-O-tert-butyl 4-O-ethyl 5-(1-phenylethylamino)-3,6-dihydro-2H-pyridine-1,4-dicarboxylate

Product 1

HCID 23590625Ethyl 1-Boc-3-(1-phenylethylamino)piperidine-4-carboxylate

Sources & evidence

ORD record
ord-e96a799eb18e4014adc9172f9d6cdfd1
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Reaction notes

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