3-(aminomethyl)-4,6-dimethylpyridin-2(1H)-one hydrochloride

Base Information

• Chemical Name: 3-(aminomethyl)-4,6-dimethylpyridin-2(1H)-one hydrochloride
• CAS No.: 1173081-96-3
• Molecular Formula: C8 H13ClN2O
• Molecular Weight: 188.657
• Hs Code.: 2933399090
• European Community (EC) Number: 822-586-4
• DSSTox Substance ID: DTXSID00656384
• Mol file: 1173081-96-3.mol

Synonyms:1173081-96-3;3-(aminomethyl)-4,6-dimethylpyridin-2(1H)-one hydrochloride;3-(AMINOMETHYL)-4,6-DIMETHYL-1,2-DIHYDROPYRIDIN-2-ONE HYDROCHLORIDE;3-(aminomethyl)-4,6-dimethyl-1H-pyridin-2-one hydrochloride;MFCD09053337;3-(AMINOMETHYL)-4,6-DIMETHYL-1H-PYRIDIN-2-ONE, HCL;3-(aminomethyl)-4,6-dimethyl-1H-pyridin-2-one;hydrochloride;3-(AMINOMETHYL)-4,6-DIMETHYLPYRIDIN-2(1H)-ONE HCL;3-(aminomethyl)-4,6-dimethyl-1H-pyridin-2-one HCl;SCHEMBL1694763;DTXSID00656384;YWB08196;AKOS016008813;DS-4627;PB10649;AM803009;SY031441;CS-0046808;FT-0704428;EN300-14701;H10959;A893396;3-(aminomethyl)-4,6-dimethyl-2(1H)-pyridinone HCl;3-(aminomethyl)-4,6-dimethyl-2(1H)-pyridinone HCl salt;3-(aminomethyl)-4,6-dimethylpyridin-2(1H)-onehydrochloride;3-aminomethyl-4,6-dimethyl-1H-pyridin-2-one hydrochloride;3-(Aminomethyl)-4,6-dimethyl-2(1H)-pyridinone hydrochloride;3-(aminomethyl)-4,6-dimethylpyridin-2(1H)-one, hydrochloride;(4,6-dimethyl-2-oxo-1,2-dihydropyridin-3-yl)methanaminium chloride;3-(Aminomethyl)-4,6-dimethyl-1,2-dihydropyridin-2-one HCl Salt;3-(aminomethyl)-4,6-dimethylpyridin-2(1H)-one hydrochloride salt;3-(aminomethyl)-4,6-dimethylpyridin-2(1H)-one hydrochloride, AldrichCPR;3-(Aminomethyl)-4,6-dimethylpyridin-2(1H)-one--hydrogen chloride (1/1)

Chemical Property of 3-(aminomethyl)-4,6-dimethylpyridin-2(1H)-one hydrochloride

Chemical Property:

• Melting Point: 312-315℃
• PSA: 59.14000
• LogP: 2.36500
• Storage Temp.: Inert atmosphere,Room Temperature
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 188.0716407
• Heavy Atom Count: 12
• Complexity: 251

Purity/Quality:

98%,99%, ^*data from raw suppliers

3-(Aminomethyl)-4,6-dimethyl-1h-pyridin-2-oneHydrochloride ^*data from reagent suppliers

Safty Information:

• Statements: 36
• Safety Statements: 26

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC(=C(C(=O)N1)CN)C.Cl
• Uses: 3-(aMinoMethyl)-4,6-diMethyl-1,2-dihydropyridin-2-one hydrochloride belongs to heterocyclic derivatives and can be used as pharmaceutical intermediates.

Technology Process of 3-(aminomethyl)-4,6-dimethylpyridin-2(1H)-one hydrochloride

There total 9 articles about 3-(aminomethyl)-4,6-dimethylpyridin-2(1H)-one 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: 96.9%

3-Cyano-4,6-dimethyl-2(1H)-pyridon (769-28-8) → (4,6-dimethyl-2-oxo-1,2-dihydropyridin-3-yl)methylamine hydrochloride (1173081-96-3)

Guidance literature:

3-Cyano-4,6-dimethyl-2(1H)-pyridon; With ammonium hydroxide; nickel; In methanol; at 50 ℃; for 11h; Inert atmosphere;

With hydrogenchloride; In methanol; ethanol; for 1h; Solvent; Cooling with ice;

Reference yield: 55.0%

tert-butyl [(2-methoxy-4,6-dimethylpyridin-3-yl)methyl]carbamate (1616288-77-7) → (4,6-dimethyl-2-oxo-1,2-dihydropyridin-3-yl)methylamine hydrochloride (1173081-96-3)

Guidance literature:

With hydrogenchloride; In water; at 100 ℃; for 6h;

Reference yield: 40.0%

tert-butyl ((4,6-dimethyl-2-oxo-1,2-dihydropyridin-3-yl)methyl)carbamate → (4,6-dimethyl-2-oxo-1,2-dihydropyridin-3-yl)methylamine hydrochloride (1173081-96-3)

Guidance literature:

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

upstream raw materials:

3-Cyano-4,6-dimethyl-2(1H)-pyridon

3-(aminomethyl)-4,6-dimethyl-1,2-dihydropyridin-2-one

acetylacetone

2-chloro-4,6-dimethylnicotinonitrile

Downstream raw materials:

6-{3-[(dimethylamino)methyl]-4-fluorophenyl}-N-[(4,6-dimethyl-2-oxo-1,2-dihydro-3-pyridinyl)methyl]-3-methyl-1-(1-methylethyl)-1H-indole-4-carboxamide

5-bromo-N-((4,6-dimethyl-2-oxo-1,2-dihydropyridin-3-yl)methyl)-3-(isopropyl(methyl)amino)-2-methylbenzamide

Refernces

• 1、 Zhou, Qifan,Jia, Lina,Du, Fangyu,Dong, Xiaoyu,Sun, Wanyu,Wang, Lihui,Chen, Guoliang. "Design, synthesis and biological activities of pyrrole-3-carboxamide derivatives as EZH2 (enhancer of zeste homologue 2) inhibitors and anticancer agents". supporting information. p. 2247 - 2255. Retrieved 2020/02/20.
• 2、 -. "Pyrrole-3-formamide compound as well as preparation method and application thereof". Paragraph 0124; 0127; 0128; 0153; 0154; 0155; 0157. . Retrieved 2019/02/25.