Hydrochloric Acid → tert-Butyl (1-(5-oxo-4-(m-tolylamino)-6,7-dihydro-5H-pyrrolo[3,4-d]pyrimidin-2-yl)piperidin-2-yl)methylcarbamate

HRID 288535Notes

Reaction equation

HRID 288535 reaction equation
[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[NH:8][CH2:9][CH:10]1[N:11]([c:16]2[n:17][c:18]([NH:28][c:29]3[cH:30][c:31]([CH3:35])[cH:32][cH:33][cH:34]3)[c:19]([C:24](=[O:25])[O:26][CH3:27])[c:20]([C:22]#[N:23])[n:21]2)[CH2:12][CH2:13][CH2:14][CH2:15]1.[CH3:37][CH2:38][OH:39].[ClH:36]>>[C:1]([CH3:2])([CH3:3])([CH3:4])[O:5][C:6](=[O:7])[NH:8][CH2:9][CH:10]1[N:11]([c:16]2[n:17][c:18]([NH:28][c:29]3[cH:30][c:31]([CH3:35])[cH:32][cH:33][cH:34]3)[c:19]3[c:20]([n:21]2)[CH2:22][NH:23][C:24]3=[O:25])[CH2:12][CH2:13][CH2:14][CH2:15]1

Participants

4

Reactant 3

HCID 313Hydrochloric AcidHCID 702EthanolHCID 67238205Methyl 2-(2-((tert-butoxycarbonylamino)methyl)piperidin-1-yl)-4-cyano-6-(m-tolylamino)pyrimidine-5-carboxylate

Product 1

HCID 86654716tert-Butyl (1-(5-oxo-4-(m-tolylamino)-6,7-dihydro-5H-pyrrolo[3,4-d]pyrimidin-2-yl)piperidin-2-yl)methylcarbamate

Sources & evidence

ORD record
ord-d32195ca6f4f44c1913a9a1878f1cb00
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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