Hydrochloric Acid → 1-{2-[(5-chloropyridin-2-yl)amino]-2-oxoethyl}-5-(2-methoxyethoxy)-N-[1-(propan-2-yl)piperidin-4-yl]-1H-pyrrolo[2,3-c]pyridine-2-carboxamide

HRID 215144Notes

Reaction equation

HRID 215144 reaction equation
[Br:32][CH2:33][C:34](=[O:35])[NH:36][c:37]1[n:38][cH:39][c:40]([Cl:43])[cH:41][cH:42]1.[CH3:46][C:47]#[N:48].[CH:1]([CH3:2])([CH3:3])[N:4]1[CH2:5][CH2:6][CH:7]([NH:10][C:11](=[O:12])[c:13]2[cH:14][c:15]3[c:16]([cH:17][n:18][c:19]([O:21][CH2:22][CH2:23][O:24][CH3:25])[cH:20]3)[nH:26]2)[CH2:8][CH2:9]1.[ClH:44].[O:27]=[CH:28][N:29]([CH3:30])[CH3:31].[OH2:45]>>[CH:1]([CH3:2])([CH3:3])[N:4]1[CH2:5][CH2:6][CH:7]([NH:10][C:11](=[O:12])[c:13]2[cH:14][c:15]3[c:16]([cH:17][n:18][c:19]([O:21][CH2:22][CH2:23][O:24][CH3:25])[cH:20]3)[n:26]2[CH2:33][C:34](=[O:35])[NH:36][c:37]2[n:38][cH:39][c:40]([Cl:43])[cH:41][cH:42]2)[CH2:8][CH2:9]1

Participants

7

Reactant 6

HCID 313Hydrochloric AcidHCID 962WaterHCID 6228DimethylformamideHCID 6342AcetonitrileHCID 34211102-Bromo-N-(5-chloro-2-pyridinyl)acetamideHCID 865958665-(2-Methoxy-ethoxy)-1H-pyrrolo[2,3-c]pyridine-2-carboxylic acid (1-isopropyl-piperidin-4-yl)-amide

Product 1

HCID 533163881-{2-[(5-chloropyridin-2-yl)amino]-2-oxoethyl}-5-(2-methoxyethoxy)-N-[1-(propan-2-yl)piperidin-4-yl]-1H-pyrrolo[2,3-c]pyridine-2-carboxamide

Sources & evidence

ORD record
ord-6c36c9c520c04435a19b6600ece8d3a9
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (6/10)

Reaction notes

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