(R)-N-(2-oxo-2-(pyrrolidin-3-ylaMino)-ethyl)-3-(trifluoroMethyl)benzaMide

Base Information

• Chemical Name: (R)-N-(2-oxo-2-(pyrrolidin-3-ylaMino)-ethyl)-3-(trifluoroMethyl)benzaMide
• CAS No.: 226249-16-7
• Molecular Formula: C14H16F3N3O2
• Molecular Weight: 315.295
• Mol file: 226249-16-7.mol

Synonyms:N-{2-oxo-2-[(3R)-pyrrolidin-3-ylamino]ethyl }-3-(trifluoromethyl)benzamide;N-(pyrrolidine-(3R)-yl-carbamoylmethyl)-3-trifluoromethylbenzamide;(R)-N-[2-oxo-2(pyrrolidin-3-ylamino)ethyl]-3-(trifluoromethyl)benzamide;N-{2-oxo-2-[(3R)-pyrrolidin-3-ylamino]ethyl}-3-(trifluoromethyl)benzamide;(R)-3-[N-[3-(trifluoromethyl)benzoyl]glycyl]aminopyrrolidine;

Chemical Property of (R)-N-(2-oxo-2-(pyrrolidin-3-ylaMino)-ethyl)-3-(trifluoroMethyl)benzaMide

Chemical Property:

• Boiling Point: 518.9±50.0 °C(Predicted)
• PKA: 12.94±0.46(Predicted)
• PSA: 70.23000
• Density: 1.33±0.1 g/cm3(Predicted)
• LogP: 2.02390

Purity/Quality:

NLT 98% ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

Technology Process of (R)-N-(2-oxo-2-(pyrrolidin-3-ylaMino)-ethyl)-3-(trifluoroMethyl)benzaMide

There total 5 articles about (R)-N-(2-oxo-2-(pyrrolidin-3-ylaMino)-ethyl)-3-(trifluoroMethyl)benzaMide which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 96.0%

(R)-N-(2-(1-benzylpyrrolidin-3-ylamino)-2-oxoethyl)-3-(trifluoromethyl)benzamide (226228-88-2,226228-42-8) → (R)-N-(2-oxo-2-(pyrrolidin-3-ylamino)-ethyl)-3-(trifluoromethyl)benzamide (226249-16-7)

Guidance literature:

With hydrogen; palladium(II) hydroxide; In methanol; at 20 ℃; under 2844.39 Torr;

DOI:10.1021/ml200030q

Reference yield: 82.0%

N-[(1-benzylpyrrolidine-(3R)-yl-carbamoyl)-methyl]-3-trifluoromethylbenzamide → (R)-N-(2-oxo-2-(pyrrolidin-3-ylamino)-ethyl)-3-(trifluoromethyl)benzamide (226249-16-7)

Guidance literature:

palladium(II) hydroxide; In methanol; at 20 ℃; under 760.051 Torr;

Reference yield:

m-trifluoromethylhippuric acid (17794-48-8) → (R)-N-(2-oxo-2-(pyrrolidin-3-ylamino)-ethyl)-3-(trifluoromethyl)benzamide (226249-16-7)

Guidance literature:

Multi-step reaction with 3 steps

1: 4-methyl-morpholine / tetrahydrofuran / 0.25 h / -15 - -10 °C / Inert atmosphere

2: tetrahydrofuran / 1.33 h / -10 °C / Inert atmosphere

3: hydrogen; palladium(II) hydroxide / methanol / 20 °C / 2844.39 Torr

With 4-methyl-morpholine; hydrogen; palladium(II) hydroxide; In tetrahydrofuran; methanol;

DOI:10.1021/ml200030q

upstream raw materials:

(R)-N-(2-(1-benzylpyrrolidin-3-ylamino)-2-oxoethyl)-3-(trifluoromethyl)benzamide

m-trifluoromethylhippuric acid

3-(Trifluoromethyl)benzoyl chloride