N₁-{(3S)-1-[2-cyano-4-(trifluoromethyl)phenyl]-3-pyrrolidinyl}-L-alaninamide-d1 hydrochloride

Base Information

• Chemical Name: N₁-{(3S)-1-[2-cyano-4-(trifluoromethyl)phenyl]-3-pyrrolidinyl}-L-alaninamide-d1 hydrochloride
• CAS No.: 1269408-86-7
• Molecular Formula: C₁₅H₁₇F₃N₄O*ClH
• Molecular Weight: 363.774

Synonyms:N₁-{(3S)-1-[2-cyano-4-(trifluoromethyl)phenyl]-3-pyrrolidinyl}-L-alaninamide-d1 hydrochloride

Chemical Property of N₁-{(3S)-1-[2-cyano-4-(trifluoromethyl)phenyl]-3-pyrrolidinyl}-L-alaninamide-d1 hydrochloride

Chemical Property:

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Technology Process of N₁-{(3S)-1-[2-cyano-4-(trifluoromethyl)phenyl]-3-pyrrolidinyl}-L-alaninamide-d1 hydrochloride

There total 4 articles about N₁-{(3S)-1-[2-cyano-4-(trifluoromethyl)phenyl]-3-pyrrolidinyl}-L-alaninamide-d1 hydrochloride 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: 77.0%

1,1-dimethylethyl [(1S)-2-({(3S)-1-[2-cyano-4-(trifluoromethyl)phenyl]-3-pyrrolidin-yl}amino)-1-methyl-2-oxoethyl]carbamate-d1 (1269407-91-1) → N1-{(3S)-1-[2-cyano-4-(trifluoromethyl)phenyl]-3-pyrrolidinyl}-L-alaninamide-d1 hydrochloride (1269408-86-7)

Guidance literature:

With hydrogenchloride; In 1,4-dioxane; at 20 ℃; for 1h;

Reference yield:

1,1-dimethylethyl {(3S)-1-[2-cyano-4-(trifluoromethyl)phenyl]-3-pyrrolidinyl}carbamate (1269407-02-4) → N1-{(3S)-1-[2-cyano-4-(trifluoromethyl)phenyl]-3-pyrrolidinyl}-L-alaninamide-d1 hydrochloride (1269408-86-7)

Guidance literature:

Multi-step reaction with 3 steps

1: hydrogenchloride / 1,4-dioxane / 1 h / 20 °C

2: triethylamine; HATU / dichloromethane / 1 h / 20 °C

3: hydrogenchloride / 1,4-dioxane / 1 h / 20 °C

With hydrogenchloride; triethylamine; HATU; In 1,4-dioxane; dichloromethane;

Reference yield:

2-[(3S)-3-amino-1-pyrrolidinyl]-5-(trifluoromethyl)benzonitrile hydrochloride (1269407-03-5) → N1-{(3S)-1-[2-cyano-4-(trifluoromethyl)phenyl]-3-pyrrolidinyl}-L-alaninamide-d1 hydrochloride (1269408-86-7)

Guidance literature:

Multi-step reaction with 2 steps

1: triethylamine; HATU / dichloromethane / 1 h / 20 °C

2: hydrogenchloride / 1,4-dioxane / 1 h / 20 °C

With hydrogenchloride; triethylamine; HATU; In 1,4-dioxane; dichloromethane;

upstream raw materials:

1,1-dimethylethyl [(1S)-2-({(3S)-1-[2-cyano-4-(trifluoromethyl)phenyl]-3-pyrrolidin-yl}amino)-1-methyl-2-oxoethyl]carbamate-d1

1,1-dimethylethyl {(3S)-1-[2-cyano-4-(trifluoromethyl)phenyl]-3-pyrrolidinyl}carbamate

2-[(3S)-3-amino-1-pyrrolidinyl]-5-(trifluoromethyl)benzonitrile hydrochloride

2-fluoro-5-trifluoromethyl-benzonitrile

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