Hydrochloric Acid → N-[6-methyl-5-(2-methylphenyl)-2-oxo-1-(2,2,2-trifluoroethyl)piperidin-3-yl]-2-oxospiro[1H-pyrrolo[2,3-b]pyridine-3,6'-5,7-dihydrocyclopenta[b]pyridine]-3'-carboxamide

HRID 2318910Notes

Reaction equation

HRID 2318910 reaction equation
[CH2:2]([N:3]=[C:4]=[N:5][CH2:6][CH2:7][CH2:8][N:9]([CH3:10])[CH3:11])[CH3:12].[CH3:66][CH2:67][N:68]([CH2:69][CH3:70])[CH2:71][CH3:72].[ClH:1].[ClH:34].[NH2:35][CH:36]1[C:37](=[O:55])[N:38]([CH2:50][C:51]([F:52])([F:53])[F:54])[CH:39]([CH3:49])[CH:40]([c:42]2[c:43]([CH3:48])[cH:44][cH:45][cH:46][cH:47]2)[CH2:41]1.[O:13]=[C:14]1[NH:15][c:16]2[n:17][cH:18][cH:19][cH:20][c:21]2[C:22]12[CH2:23][c:24]1[c:25]([n:26][cH:27][c:28]([C:30](=[O:31])[OH:32])[cH:29]1)[CH2:33]2.[O:73]=[CH:74][N:75]([CH3:76])[CH3:77].[n:56]1[c:57]2[c:58]([n:59][cH:60][cH:61][cH:62]2)[n:63]([OH:64])[n:65]1>>[O:13]=[C:14]1[NH:15][c:16]2[n:17][cH:18][cH:19][cH:20][c:21]2[C:22]12[CH2:23][c:24]1[c:25]([n:26][cH:27][c:28]([C:30](=[O:32])[NH:35][CH:36]3[C:37](=[O:55])[N:38]([CH2:50][C:51]([F:52])([F:53])[F:54])[CH:39]([CH3:49])[CH:40]([c:42]4[c:43]([CH3:48])[cH:44][cH:45][cH:46][cH:47]4)[CH2:41]3)[cH:29]1)[CH2:33]2

Participants

8

Reactant 7

HCID 313Hydrochloric Acid2×HCID 6228DimethylformamideHCID 8471TriethylamineHCID 159081-Ethyl-3-(3'-dimethylaminopropyl)carbodiimideHCID 181649HOAtHCID 775480982'-Oxo-1',2',5,7-tetrahydrospiro[cyclopenta[b]pyridine-6,3'-pyrrolo[2,3-b]pyridine]-3-carboxylic acidHCID 775481313-Amino-6-methyl-5-(2-methylphenyl)-1-(2,2,2-trifluoroethyl)piperidin-2-one

Product 1

HCID 76514704N-[6-methyl-5-(2-methylphenyl)-2-oxo-1-(2,2,2-trifluoroethyl)piperidin-3-yl]-2-oxospiro[1H-pyrrolo[2,3-b]pyridine-3,6'-5,7-dihydrocyclopenta[b]pyridine]-3'-carboxamide

Sources & evidence

ORD record
ord-abf3753412754e3a9331bf11440bef76
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (10/10)

Reaction notes

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