Acetic Acid → HCID 11516307, compound

HRID 174426Notes

Reaction equation

HRID 174426 reaction equation
[C:1]([BH3-:2])#[N:3].[CH2:4]1[CH2:5][CH2:6][NH:7][CH2:8][CH2:9]1.[CH3:10][C:11](=[O:12])[OH:13].[CH3:36][C:37]#[N:38].[O:14]=[CH:15][CH2:16][CH2:17][c:18]1[n:19][c:20]([C:34]#[N:35])[n:21][c:22](-[c:24]2[cH:25][c:26]([C:30]([F:31])([F:32])[F:33])[cH:27][cH:28][cH:29]2)[cH:23]1>>[CH2:4]1[CH2:5][CH2:6][N:7]([CH2:15][CH2:16][CH2:17][c:18]2[n:19][c:20]([C:34]#[N:35])[n:21][c:22](-[c:24]3[cH:25][c:26]([C:30]([F:31])([F:32])[F:33])[cH:27][cH:28][cH:29]3)[cH:23]2)[CH2:8][CH2:9]1

Participants

6

Reactant 5

HCID 176Acetic AcidHCID 6342AcetonitrileHCID 8082PiperidineHCID 498716Cyano-borohydrideHCID 86619632HCID 86619632, compound

Product 1

HCID 11516307HCID 11516307, compound

Sources & evidence

ORD record
ord-8164d7f18f7d43b18f398a55b72b5bc9
Source dataset
Training data from https://doi.org/10.1039/C8SC04228D (9/10)

Reaction notes

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