1-Acetyl-3-Aminopyrrolidine

Base Information

• Chemical Name: 1-Acetyl-3-Aminopyrrolidine
• CAS No.: 833483-45-7
• Molecular Formula: C6H12N2O
• Molecular Weight: 128.174
• Hs Code.: 2933990090
• European Community (EC) Number: 862-714-6
• DSSTox Substance ID: DTXSID20458968
• Mol file: 833483-45-7.mol

Synonyms:1-Acetyl-3-Aminopyrrolidine;833483-45-7;1-(3-aminopyrrolidin-1-yl)ethanone;1-(3-Amino-pyrrolidin-1-yl)-ethanone;3-Pyrrolidinamine, 1-acetyl-;1-ACETYL-3-PYRROLIDINAMINE;MFCD11849569;1-ACETYL-(3R)-3-PYRROLIDINAMINE;1-(3-AMINOPYRROLIDIN-1-YL)ETHAN-1-ONE;SCHEMBL69055;DTXSID20458968;QTFVAHXVSVHNQR-UHFFFAOYSA-N;AKOS011345440;PB28324;SB45179;AM101330;AS-31658;SY005627;CS-0052894;FT-0768189;EN300-148199;A864271;J-504159

Chemical Property of 1-Acetyl-3-Aminopyrrolidine

Chemical Property:

• PSA: 46.33000
• LogP: 0.20410
• Storage Temp.: 2-8°C(protect from light)
• XLogP3: -1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 128.094963011
• Heavy Atom Count: 9
• Complexity: 124

Purity/Quality:

98%min ^*data from raw suppliers

1-Acetyl-3-aminopyrrolidine ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(=O)N1CCC(C1)N

Technology Process of 1-Acetyl-3-Aminopyrrolidine

There total 1 articles about 1-Acetyl-3-Aminopyrrolidine 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:

(R)-tert-butyl 1-acetylpyrrolidin-3-ylcarbamate (881298-14-2) → 1‐(3‐aminopyrrolidin‐1‐yl)ethan‐1‐one (833483-45-7)

Guidance literature:

With trifluoroacetic acid; In dichloromethane; at 20 ℃; for 14h;

Reference yield: 47.0%

1‐(3‐aminopyrrolidin‐1‐yl)ethan‐1‐one (833483-45-7) + C13H11Br2N5O3S → C19H22BrN7O4S

Guidance literature:

C₁₃H₁₁Br₂N₅O₃S; With triethylamine; In N,N-dimethyl-formamide; at 20 ℃; for 0.166667h;

1‐(3‐aminopyrrolidin‐1‐yl)ethan‐1‐one; In N,N-dimethyl-formamide; for 15h; Reflux;

Reference yield:

5-fluoro-2-(3-methylsulphanyl-phenoxy)-nicotinic acid (832099-55-5) + 1‐(3‐aminopyrrolidin‐1‐yl)ethan‐1‐one (833483-45-7) → N-(1-Acetyl-pyrrolidine-3-yl)-5-fluoro-2-(3-methylsulfanyl-phenoxy)-nicotinamide

Guidance literature:

5-fluoro-2-(3-methylsulphanyl-phenoxy)-nicotinic acid; With 1,1'-carbonyldiimidazole; In dichloromethane; at 20 ℃; for 0.25h;

1‐(3‐aminopyrrolidin‐1‐yl)ethan‐1‐one; With dmap; In dichloromethane; at 20 ℃; for 4h;

upstream raw materials:

(R)-tert-butyl 1-acetylpyrrolidin-3-ylcarbamate

Refernces