N-(2-((Methylsulfonyl)amino)-5-(trifluoromethyl)-3-pyridinyl)-3-cyclohexene-1-carboxamide

Base Information

Chemical Name:N-(2-((Methylsulfonyl)amino)-5-(trifluoromethyl)-3-pyridinyl)-3-cyclohexene-1-carboxamide
CAS No.:141284-08-4
Molecular Formula:C₁₄H₁₆F₃N₃O₃S
Molecular Weight:363.361
Hs Code.:
DSSTox Substance ID:DTXSID80931065

Synonyms:N-(2-((Methylsulfonyl)amino)-5-(trifluoromethyl)-3-pyridinyl)-3-cyclohexene-1-carboxamide;3-Cyclohexene-1-carboxamide, N-(2-((methylsulfonyl)amino)-5-(trifluoromethyl)-3-pyridinyl)-;141284-08-4;C14H16F3N3O3S;DTXSID80931065;C14-H16-F3-N3-O3-S;LS-57419;N-{2-[(Methanesulfonyl)amino]-5-(trifluoromethyl)pyridin-3-yl}cyclohex-3-ene-1-carboximidic acid

Suppliers and Price of N-(2-((Methylsulfonyl)amino)-5-(trifluoromethyl)-3-pyridinyl)-3-cyclohexene-1-carboxamide

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

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Chemical Property of N-(2-((Methylsulfonyl)amino)-5-(trifluoromethyl)-3-pyridinyl)-3-cyclohexene-1-carboxamide

Chemical Property:

Density:1.479g/cm³
XLogP3:1.7
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:8
Rotatable Bond Count:4
Exact Mass:363.08644704
Heavy Atom Count:24
Complexity:586

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CS(=O)(=O)NC1=C(C=C(C=N1)C(F)(F)F)NC(=O)C2CCC=CC2

Technology Process of N-(2-((Methylsulfonyl)amino)-5-(trifluoromethyl)-3-pyridinyl)-3-cyclohexene-1-carboxamide

There total 4 articles about N-(2-((Methylsulfonyl)amino)-5-(trifluoromethyl)-3-pyridinyl)-3-cyclohexene-1-carboxamide 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%

: 4771-80-6
1,2,5,6-tetrahydrobenzoic acid

: 141284-81-3
N-(3-amino-5-trifluoromethyl-pyridin-2-yl)-methanesulfonamide

: 141284-08-4
Cyclohex-3-enecarboxylic acid (2-methanesulfonylamino-5-trifluoromethyl-pyridin-3-yl)-amide

Guidance literature:: With dmap; 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; In dichloromethane; for 24h; Ambient temperature;
DOI:10.1248/cpb.43.1696

Reference yield:

: 52334-81-3
2-chloro-5-trifluoromethylpyridine

: 141284-08-4
Cyclohex-3-enecarboxylic acid (2-methanesulfonylamino-5-trifluoromethyl-pyridin-3-yl)-amide

Guidance literature:: Multi-step reaction with 4 steps

1: K₂CO₃ / dimethylsulfoxide / 7 h / 110 - 120 °C

2: 94percent aq. HNO₃ / acetic acid / 6 h / 105 - 110 °C

3: Fe, CH₃COOH / 1 h / 65 °C

4: 77 percent / 4-dimethylaminopyridine, 1-ethyl-3-(3-dimethylaminopropyl)carbodiimide hydrochloride / CH₂Cl₂ / 24 h / Ambient temperature

With dmap; nitric acid; iron; potassium carbonate; acetic acid; 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; In dichloromethane; acetic acid; dimethyl sulfoxide;
DOI:10.1248/cpb.43.1696

Reference yield:

: 141284-83-5
N-[5-(Trifluoromethyl)pyridin-2-yl]methanesulfonamide

: 141284-08-4
Cyclohex-3-enecarboxylic acid (2-methanesulfonylamino-5-trifluoromethyl-pyridin-3-yl)-amide

Guidance literature:: Multi-step reaction with 3 steps

1: 94percent aq. HNO₃ / acetic acid / 6 h / 105 - 110 °C

2: Fe, CH₃COOH / 1 h / 65 °C

3: 77 percent / 4-dimethylaminopyridine, 1-ethyl-3-(3-dimethylaminopropyl)carbodiimide hydrochloride / CH₂Cl₂ / 24 h / Ambient temperature

With dmap; nitric acid; iron; acetic acid; 1-ethyl-(3-(3-dimethylamino)propyl)-carbodiimide hydrochloride; In dichloromethane; acetic acid;
DOI:10.1248/cpb.43.1696