3-amino-N-cyclopropyl-4-methylbenzamide

Base Information

• Chemical Name: 3-amino-N-cyclopropyl-4-methylbenzamide
• CAS No.: 623155-19-1
• Molecular Formula: C11H14N2O
• Molecular Weight: 190.245
• Hs Code.: 2924299090
• European Community (EC) Number: 809-470-9
• DSSTox Substance ID: DTXSID30475166
• Wikidata: Q82305465
• Mol file: 623155-19-1.mol

Synonyms:3-amino-N-cyclopropyl-4-methylbenzamide;623155-19-1;3-amino-N-cyclopropyl-4-methyl-benzamide;HEXABROMOSTEARICACID;SCHEMBL178414;DTXSID30475166;NLESBTVHGWTLOM-UHFFFAOYSA-N;YZA15519;MFCD09042800;AKOS000126657;SB37973;Benzamide,3-amino-N-cyclopropyl-4-methyl;CS-0199883;EN300-42090;A915763;A1-08935;3-Amino-N-cyclopropyl-4-methyl-benzamide, AldrichCPR;Z239124620

Chemical Property of 3-amino-N-cyclopropyl-4-methylbenzamide

Chemical Property:

• PSA: 58.61000
• LogP: 2.62540
• XLogP3: 1.4
• Hydrogen Bond Donor Count: 2
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 190.110613074
• Heavy Atom Count: 14
• Complexity: 225

Purity/Quality:

97% ^*data from raw suppliers

3-amino-N-cyclopropyl-4-methylbenzamide ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=C(C=C(C=C1)C(=O)NC2CC2)N

Technology Process of 3-amino-N-cyclopropyl-4-methylbenzamide

There total 6 articles about 3-amino-N-cyclopropyl-4-methylbenzamide 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: 100.0%

3-amino-p-toluic acid (2458-12-0) + Cyclopropylamine (765-30-0) → 3-amino-N-cyclopropyl-4-methylbenzamide (623155-19-1)

Guidance literature:

With 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; dmap; In N,N-dimethyl-formamide; at 0 - 20 ℃;

Reference yield: 100.0%

3-amino-p-toluic acid (2458-12-0) + benzotriazol-1-ol (2592-95-2) + Cyclopropylamine (765-30-0) → 3-amino-N-cyclopropyl-4-methylbenzamide (623155-19-1)

Guidance literature:

With 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; N-ethyl-N,N-diisopropylamine; In tetrahydrofuran; DMF (N,N-dimethyl-formamide); at 54 ℃; for 1.83333h;

Reference yield: 94.0%

N-cyclopropyl-4-methyl-3-nitrobenzamide (303133-89-3) → 3-amino-N-cyclopropyl-4-methylbenzamide (623155-19-1)

Guidance literature:

With palladium 10% on activated carbon; hydrogen; In ethanol; at 20 ℃;

DOI:10.1016/j.bmcl.2012.04.116

upstream raw materials:

3-amino-p-toluic acid

benzotriazol-1-ol

Cyclopropylamine

N-cyclopropyl-4-methyl-3-nitrobenzamide

Downstream raw materials:

3-chloro-N-{5-[(cyclopropylamino)carbonyl]-2-methylphenyl}-2-nitrobenzamide

N-cyclopropyl-4-methyl-3-[(2-nitrobenzoyl)amino]benzamide

N-{5-[(cyclopropylamino)carbonyl]-2-methylphenyl}-4-methoxy-2-nitrobenzamide

5-chloro-N-{5-[(cyclopropylamino)carbonyl]-2-methylphenyl}-2-nitrobenzamide