Potassium Cation → 8-{2-Fluoro-5-[6-(pyrrolidin-1-ylcarbonyl)pyridin-3-yl]phenyl}-2-(cis-4-hydroxycyclohexyl)-2,8-di azaspiro[4.5]decan-1-one

HRID 282464Notes

Reaction equation

HRID 282464 reaction equation
[Br:9][c:10]1[cH:11][cH:12][c:13]([F:34])[c:14]([N:16]2[CH2:17][CH2:18][C:19]3([CH2:20][CH2:21][N:22]([CH:25]4[CH2:26][CH2:27][CH:28]([OH:31])[CH2:29][CH2:30]4)[C:23]3=[O:24])[CH2:32][CH2:33]2)[cH:15]1.[CH2:58]1[O:59][CH2:60][CH2:61][O:62][CH2:63]1.[K+:6].[K+:7].[K+:8].[N:35]1([C:40](=[O:41])[c:42]2[n:43][cH:44][c:45]([B:48]3[O:49][C:50]([CH3:51])([CH3:52])[C:53]([CH3:54])([CH3:55])[O:56]3)[cH:46][cH:47]2)[CH2:36][CH2:37][CH2:38][CH2:39]1.[OH2:57].[P:1]([O-:2])([O-:3])([O-:4])=[O:5].[cH:64]1[cH:65][cH:66][c:67]([P:68]([Pd:69]([P:70]([c:71]2[cH:72][cH:73][cH:74][cH:75][cH:76]2)([c:77]2[cH:78][cH:79][cH:80][cH:81][cH:82]2)[c:83]2[cH:84][cH:85][cH:86][cH:87][cH:88]2)([P:89]([c:90]2[cH:91][cH:92][cH:93][cH:94][cH:95]2)([c:96]2[cH:97][cH:98][cH:99][cH:100][cH:101]2)[c:102]2[cH:103][cH:104][cH:105][cH:106][cH:107]2)[P:108]([c:109]2[cH:110][cH:111][cH:112][cH:113][cH:114]2)([c:115]2[cH:116][cH:117][cH:118][cH:119][cH:120]2)[c:121]2[cH:122][cH:123][cH:124][cH:125][cH:126]2)([c:127]2[cH:128][cH:129][cH:130][cH:131][cH:132]2)[c:133]2[cH:134][cH:135][cH:136][cH:137][cH:138]2)[cH:139][cH:140]1>>[c:10]1(-[c:45]2[cH:44][n:43][c:42]([C:40]([N:35]3[CH2:36][CH2:37][CH2:38][CH2:39]3)=[O:41])[cH:47][cH:46]2)[cH:11][cH:12][c:13]([F:34])[c:14]([N:16]2[CH2:17][CH2:18][C:19]3([CH2:20][CH2:21][N:22]([CH:25]4[CH2:26][CH2:27][CH:28]([OH:31])[CH2:29][CH2:30]4)[C:23]3=[O:24])[CH2:32][CH2:33]2)[cH:15]1

Participants

8

Reactant 7

HCID 813Potassium Cation3×HCID 962WaterHCID 1061PhosphateHCID 312751,4-DioxaneHCID 167398468-(5-Bromo-2-fluorophenyl)-2-(cis-4-hydroxycyclohexyl)-2,8-diazaspiro[4.5]decan-1-oneHCID 691788921-Pyrrolidinyl[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-YL)-2-pyridinyl]-methanoneHCID 178420554HCID 178420554, compound

Product 1

HCID 167398478-{2-Fluoro-5-[6-(pyrrolidin-1-ylcarbonyl)pyridin-3-yl]phenyl}-2-(cis-4-hydroxycyclohexyl)-2,8-di azaspiro[4.5]decan-1-one

Sources & evidence

ORD record
ord-7d4a6f6ffe244f6bbe20da15fd27871a
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (8/10)

Reaction notes

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