1,4-Dioxane → Hydrochloric Acid

HRID 144680Notes

Reaction equation

HRID 144680 reaction equation
[CH2:29]1[O:30][CH2:31][CH2:32][O:33][CH2:34]1.[CH3:1][N:2]([c:3]1[n:4][c:5]([NH2:9])[cH:6][cH:7][cH:8]1)[CH:10]1[CH2:11][CH2:12][N:13]([CH3:16])[CH2:14][CH2:15]1.[F:17][c:18]1[c:19]([C:20](=[O:21])[Cl:22])[c:23]([F:28])[cH:24][c:25]([F:27])[cH:26]1>>[CH3:1][N:2]([c:3]1[n:4][c:5]([NH:9][C:20]([c:19]2[c:18]([F:17])[cH:26][c:25]([F:27])[cH:24][c:23]2[F:28])=[O:21])[cH:6][cH:7][cH:8]1)[CH:10]1[CH2:11][CH2:12][N:13]([CH3:16])[CH2:14][CH2:15]1.[ClH:22]

Participants

5

Reactant 3

HCID 312751,4-DioxaneHCID 1448952,4,6-Trifluorobenzoyl chlorideHCID 58997271N-methyl N-(1-methyl-piperidin-4-yl)-pyridine-2,6-diamine

Product 2

HCID 313Hydrochloric AcidHCID 589972552,4,6-trifluoro-N-[6-[methyl-(1-methylpiperidin-4-yl)amino]-2-pyridinyl]benzamide

Sources & evidence

ORD record
ord-12f1c53f7cd74abbb2af05a4bc165ac0
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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