1-Butanol → tert-butyl N-[1-[5-bromo-3-[(5-methylpyridine-3-carbonyl)amino]-1H-pyrrolo[2,3-b]pyridin-4-yl]piperidin-3-yl]carbamate

HRID 1234795

Reaction equation

HRID 1234795 reaction equation
[Br:15][c:16]1[c:17]([F:35])[c:18]2[c:19]([n:20][cH:21]1)[nH:22][cH:23][c:24]2[NH:25][C:26]([c:27]1[cH:28][n:29][cH:30][c:31]([CH3:33])[cH:32]1)=[O:34].[CH2:36]([OH:37])[CH2:38][CH2:39][CH3:40].[NH:1]1[CH2:2][CH:3]([NH:7][C:8]([O:9][C:10]([CH3:11])([CH3:12])[CH3:13])=[O:14])[CH2:4][CH2:5][CH2:6]1>>[N:1]1([c:17]2[c:16]([Br:15])[cH:21][n:20][c:19]3[c:18]2[c:24]([NH:25][C:26]([c:27]2[cH:28][n:29][cH:30][c:31]([CH3:33])[cH:32]2)=[O:34])[cH:23][nH:22]3)[CH2:2][CH:3]([NH:7][C:8]([O:9][C:10]([CH3:11])([CH3:12])[CH3:13])=[O:14])[CH2:4][CH2:5][CH2:6]1

Participants

4

Reactant 3

HCID 2631-ButanolHCID 42330413-(Boc-amino)piperidineHCID 60205339N-(5-bromo-4-fluoro-1H-pyrrolo[2,3-b]pyridin-3-yl)-5-methylnicotinamide

Product 1

HCID 60205340tert-butyl N-[1-[5-bromo-3-[(5-methylpyridine-3-carbonyl)amino]-1H-pyrrolo[2,3-b]pyridin-4-yl]piperidin-3-yl]carbamate

Sources & evidence

ORD record
ord-92a9816e10d641388ed5f18ab5ac2d57
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (5/10)

Linked notes

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