1-Butanol → 6-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]-5-fluoro-2-[[1-(4-fluorophenyl)-2-hydroxyethyl]amino]pyridine-3-carbonitrile

HRID 144309Notes

Reaction equation

HRID 144309 reaction equation
[CH2:49]([OH:50])[CH2:51][CH2:52][CH3:53].[CH:1]1([c:4]2[cH:5][c:6]([NH:9][c:10]3[n:11][c:12]([NH:19][CH:20]([CH3:21])[c:22]4[cH:23][cH:24][c:25]([F:28])[cH:26][cH:27]4)[c:13]([C:14]#[N:15])[cH:16][c:17]3[F:18])[n:7][nH:8]2)[CH2:2][CH2:3]1.[CH:40]([N:41]([CH2:42][CH3:43])[CH:44]([CH3:45])[CH3:46])([CH3:47])[CH3:48].[NH2:29][CH:30]([c:31]1[cH:33][cH:34][c:35]([F:36])[cH:37][cH:38]1)[CH2:39][OH:32]>>[CH:1]1([c:4]2[cH:5][c:6]([NH:9][c:10]3[n:11][c:12]([NH:19][CH:20]([CH2:21][OH:32])[c:22]4[cH:23][cH:24][c:25]([F:28])[cH:26][cH:27]4)[c:13]([C:14]#[N:15])[cH:16][c:17]3[F:18])[n:7][nH:8]2)[CH2:2][CH2:3]1

Participants

5

Reactant 4

HCID 2631-ButanolHCID 81531DiisopropylethylamineHCID 148532012-Amino-2-(4-fluorophenyl)ethanolHCID 67426938HCID 67426938, compound

Product 1

HCID 674260426-[(5-cyclopropyl-1H-pyrazol-3-yl)amino]-5-fluoro-2-[[1-(4-fluorophenyl)-2-hydroxyethyl]amino]pyridine-3-carbonitrile

Sources & evidence

ORD record
ord-b9cd6f6a32464b918b3c25a846459c73
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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