Bicarbonate Ion → 1-(3-Cyclohexyl-3-hydroxypropyl)-4-(5-methylpyridin-2-yl)aminopiperidine

HRID 1561061Notes

Reaction equation

HRID 1561061 reaction equation
[Br:20][c:21]1[cH:22][cH:23][c:24]([S:25]([O:26][CH2:31][CH2:32][CH:33]([OH:34])[CH:35]2[CH2:36][CH2:37][CH2:38][CH2:39][CH2:40]2)(=[O:27])=[O:28])[cH:29][cH:30]1.[CH3:1][c:2]1[cH:3][cH:4][c:5]([NH:8][CH:9]2[CH2:10][CH2:11][NH:12][CH2:13][CH2:14]2)[n:6][cH:7]1.[CH3:41][O:42][CH2:43][CH2:44][O:45][CH3:46].[Na+:15].[OH:16][C:17](=[O:18])[O-:19]>>[CH3:1][c:2]1[cH:3][cH:4][c:5]([NH:8][CH:9]2[CH2:10][CH2:11][N:12]([CH2:31][CH2:32][CH:33]([OH:34])[CH:35]3[CH2:36][CH2:37][CH2:38][CH2:39][CH2:40]3)[CH2:13][CH2:14]2)[n:6][cH:7]1

Participants

6

Reactant 5

HCID 769Bicarbonate IonHCID 923Sodium ionHCID 80711,2-DimethoxyethaneHCID 207024693-Cyclohexyl-3-hydroxypropyl 4-bromobenzenesulfonateHCID 230210485-Methyl-N-(piperidin-4-YL)pyridin-2-amine

Product 1

HCID 231099131-(3-Cyclohexyl-3-hydroxypropyl)-4-(5-methylpyridin-2-yl)aminopiperidine

Sources & evidence

ORD record
ord-b0fdb8b01220490da10c11f695a29e88
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (1/10)

Reaction notes

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