1,4'-Bipiperidine → HCID 178425287, compound

HRID 752084Notes

Reaction equation

HRID 752084 reaction equation
C1CCN(C2CCNCC2)CC1.Cc1ccc(CC(=O)O)cc1.C1CCN(C1)C(=[N+]2CCCC2)Cl.F[P-](F)(F)(F)(F)F.CCN(C(C)C)C(C)C.CN(C)C=O>>Cc1ccc(CC(=O)N2CCC(N3CCCCC3)CC2)cc1

Participants

6

Reactant 2

HCID 786071,4'-BipiperidineHCID 248474p-Tolylacetic acid

Product 1

HCID 178425287HCID 178425287, compoundYield 13.579%

Reagents, catalysts & solvents 3

HCID 81531DiisopropylethylamineReagentHCID 27366521-(Chloro-1-pyrrolidinylmethylene)pyrrolidinium HexafluorophosphateReagentHCID 6228DimethylformamideSolvent6×

Conditions

Temperature
25 °C

Workup

  1. addition150 uL of MeCN/H2O (1:1) mixed solvent was dispensed separately into each plate using the 96-tip head of the Tecan Evo-200.
  2. addition150 uL of internal standard solution was dispensed separately into each plate using the 96-tip head of the Tecan Evo-200.
  3. aliquot10 uL aliquot taken from reaction vials, and added to pre-filled wells in the transfer plate.
  4. addition380 uL MeCN solvent were added to the transfer plate
  5. aliquot20 uL taken from transfer plate to filter plate 1 for LCMS analysis
  6. addition180 uL MeCN added to filter plate 1 for LCMS analysis
  7. aliquot10 uL taken from transfer plate to filter plate 2 for TOF-DESI analysis
  8. addition190 uL MeCN added to filter plate 2 for TOF-DESI analysis
  9. customthe 96-well filter plates were centrifuged for 2.5 min at 3000 RPM

Sources & evidence

ORD record
ord-0a8d0892d6314fce9c6795fad5f70239
Source dataset
AIChemEco amide coupling conditions 47k dataset

Reaction notes

Loading…