Hydrochloric Acid → [6-Chloro-5-(1-isopropyl-piperidin-4-yloxy)-1H-indol-2-yl]-(4-hydroxy-4-methyl-piperidin-1-yl)-methanone

HRID 2345634Notes

Reaction equation

HRID 2345634 reaction equation
[CH3:90][C:91]1([OH:97])[CH2:92][CH2:93][NH:94][CH2:95][CH2:96]1.[Cl:31][c:32]1[c:33]([O:44][CH:45]2[CH2:46][CH2:47][N:48]([CH:51]([CH3:52])[CH3:53])[CH2:49][CH2:50]2)[cH:34][c:35]2[cH:36][c:37]([C:41](=[O:42])[OH:43])[nH:38][c:39]2[cH:40]1.[Cl:54][c:55]1[cH:56][c:57]2[c:58]([cH:59][c:60]([C:61]([N:62]3[CH2:63][CH2:64][C:65]([F:66])([F:67])[CH2:68][CH2:69]3)=[O:70])[n:71]2-[c:72]2[cH:73][n:74][cH:75][n:76][cH:77]2)[cH:78][c:79]1[O:80][CH:81]1[CH2:82][CH2:83][N:84]([CH:85]([CH3:86])[CH3:87])[CH2:88][CH2:89]1.[ClH:30].[F:1][C:2]1([F:3])[CH2:4][CH2:5][N:6]([C:7]([c:8]2[nH:9][c:10]3[c:11]([cH:12]2)[cH:13][c:14]([O:15][CH:16]2[CH2:17][CH2:18][N:19]([CH:20]([CH3:21])[CH3:22])[CH2:23][CH2:24]2)[cH:25][cH:26]3)=[O:27])[CH2:28][CH2:29]1>>[Cl:31][c:32]1[c:33]([O:44][CH:45]2[CH2:46][CH2:47][N:48]([CH:51]([CH3:52])[CH3:53])[CH2:49][CH2:50]2)[cH:34][c:35]2[cH:36][c:37]([C:41](=[O:42])[N:94]3[CH2:93][CH2:92][C:91]([CH3:90])([OH:97])[CH2:96][CH2:95]3)[nH:38][c:39]2[cH:40]1

Participants

6

Reactant 5

HCID 313Hydrochloric AcidHCID 11603838(4,4-Difluoropiperidin-1-yl)[5-(1-isopropyl-piperidin-4-yloxy)-1H-indol-2-yl]methanoneHCID 156491744-Methylpiperidin-4-olHCID 16739632[6-Chloro-5-(1-isopropyl-piperidin-4-yloxy)-1-pyrimidin-5-yl-1H-indol-2-yl]-(4,4-difluoro-piperidin-1-yl)-methanoneHCID 670179066-chloro-5-(1-propan-2-ylpiperidin-4-yl)oxy-1H-indole-2-carboxylic acid

Product 1

HCID 67017915[6-Chloro-5-(1-isopropyl-piperidin-4-yloxy)-1H-indol-2-yl]-(4-hydroxy-4-methyl-piperidin-1-yl)-methanone

Sources & evidence

ORD record
ord-65b2c40758a442c2914aa2d7d29fa83c
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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