Hydrochloric Acid → 4-amino-N-[1-(4-chlorophenyl)-3-hydroxypropyl]-1-(5-cyclopropyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl)piperidine-4-carboxamide

HRID 2153956Notes

Reaction equation

HRID 2153956 reaction equation
[CH3:48][OH:49].[Cl:2][c:3]1[cH:4][cH:5][c:6]([CH:9]([CH2:10][CH2:11][OH:12])[NH:13][C:14](=[O:15])[C:16]2([NH:34][C:35](=[O:36])[O:37][C:38]([CH3:39])([CH3:40])[CH3:41])[CH2:17][CH2:18][N:19]([c:22]3[c:23]4[c:24]([n:25][cH:26][n:27]3)[nH:28][cH:29][c:30]4[CH:31]3[CH2:32][CH2:33]3)[CH2:20][CH2:21]2)[cH:7][cH:8]1.[ClH:1].[O:42]1[CH2:43][CH2:44][O:45][CH2:46][CH2:47]1>>[Cl:2][c:3]1[cH:4][cH:5][c:6]([CH:9]([CH2:10][CH2:11][OH:12])[NH:13][C:14](=[O:15])[C:16]2([NH2:34])[CH2:17][CH2:18][N:19]([c:22]3[c:23]4[c:24]([n:25][cH:26][n:27]3)[nH:28][cH:29][c:30]4[CH:31]3[CH2:32][CH2:33]3)[CH2:20][CH2:21]2)[cH:7][cH:8]1

Participants

5

Reactant 4

HCID 313Hydrochloric AcidHCID 887MethanolHCID 312751,4-DioxaneHCID 66673841tert-butyl N-[4-[[1-(4-chlorophenyl)-3-hydroxypropyl]carbamoyl]-1-(5-cyclopropyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl)piperidin-4-yl]carbamate

Product 1

HCID 666738484-amino-N-[1-(4-chlorophenyl)-3-hydroxypropyl]-1-(5-cyclopropyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl)piperidine-4-carboxamide

Sources & evidence

ORD record
ord-297b21a8ceab47b18598931ce06c978b
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (4/10)

Reaction notes

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