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Dimethylformamide → 4-Chloro-7H-pyrrolo(2,3-d)pyrimidine-5-carboxamide

HRID 709938
Notes
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Reaction equation

HRID 709938 reaction equation
[Cl:1][C:2]1[C:3]2[C:10]([C:11]([OH:13])=O)=[CH:9][NH:8][C:4]=2[N:5]=[CH:6][N:7]=1.C[N:15](C=O)C.C(Cl)(=O)C(Cl)=O>C(Cl)Cl.C1COCC1>[Cl:1][C:2]1[C:3]2[C:10]([C:11]([NH2:15])=[O:13])=[CH:9][NH:8][C:4]=2[N:5]=[CH:6][N:7]=1
ParticipantsProcedureWorkupSources & evidenceReaction notes

Participants

6

Reactant 3

HCID 6228DimethylformamideHCID 65578Oxalyl chlorideHCID 224608664-Chloro-7H-pyrrolo(2,3-d)pyrimidine-5-carboxylic acid

Product 1

HCID 593610044-Chloro-7H-pyrrolo(2,3-d)pyrimidine-5-carboxamide

Reagents, catalysts & solvents 2

HCID 6344DichloromethaneSolvent
HCID 8028
Tetrahydrofuran
Solvent

Procedure

To a stirred suspension of 4-chloro-7H-pyrrolo[2,3-d]pyrimidine-5-carboxylic acid (G-1) (3.11 g, 15.7 mmol, 1.0 eq) and a catalytic amount of DMF in a mixture of DCM (40 mL) and THF (40 mL) at RT, oxalyl dichloride (2.0 mL, 23.5 mmol, 1.5 eq) is added dropwise. The resulting mixture is stirred for 2 h and then concentrated in vacuo. The residue (G2) is dissolved in DCM (50 mL) and the resulting solution is added dropwise to saturated aqueous ammonium hydroxide (200 mL) at RT. The resulting mixture is stirred for 30 min and then filtered. The filter cake is then rinsed with H2O (30 mL×2). The filtrate is acidified with con. HCl to adjust the pH to 4-5. The solid is collected by filtration, rinsed with water and dried in vacuo to afford the product, 4-chloro-7H-pyrrolo[2,3-d]pyrimidine-5-carboxamide (G-3).

Workup

  1. concentrationconcentrated in vacuo
  2. dissolutionThe residue (G2) is dissolved in DCM (50 mL)
  3. additionthe resulting solution is added dropwise to saturated aqueous ammonium hydroxide (200 mL) at RT
  4. stirringThe resulting mixture is stirred for 30 min
  5. filtrationfiltered
  6. washThe filter cake is then rinsed with H2O (30 mL×2)
  7. filtrationThe solid is collected by filtration
  8. washrinsed with water
  9. customdried in vacuo

Sources & evidence

ORD record
ord-5a7238f7a76a43359d758f3ee4f3a9c3
Source dataset
uspto-grants-2015_11
DOI
10.6084/m9.figshare.5104873.v1
Patent number
US09181221B2

Reaction notes

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On this pageParticipantsProcedureWorkupSources & evidenceReaction notes