[1-(2-Pyridinyl)cyclohexyl]methanamine

Base Information

• Chemical Name: [1-(2-Pyridinyl)cyclohexyl]methanamine
• CAS No.: 204067-08-3
• Molecular Formula: C₁₂H₁₈N₂
• Molecular Weight: 190.288
• DSSTox Substance ID: DTXSID201287067
• Mol file: 204067-08-3.mol

Synonyms:204067-08-3;(1-(pyridin-2-yl)cyclohexyl)methanamine;[1-(2-pyridinyl)cyclohexyl]methanamine;(1-pyridin-2-ylcyclohexyl)methanamine;1-[1-(pyridin-2-yl)cyclohexyl]methanamine;[1-(pyridin-2-yl)cyclohexyl]methanamine;SCHEMBL6182607;DTXSID201287067;1-(2-Pyridinyl)cyclohexanemethanamine;AKOS006308349;CS-0531070;E80476;EN300-1850254

Chemical Property of [1-(2-Pyridinyl)cyclohexyl]methanamine

Chemical Property:

• Boiling Point: 315.4±15.0 °C(Predicted)
• PKA: 10.27±0.29(Predicted)
• Density: 1.017±0.06 g/cm3(Predicted)
• XLogP3: 2.1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 2
• Exact Mass: 190.146998583
• Heavy Atom Count: 14
• Complexity: 173

Purity/Quality:

99.3% ^*data from raw suppliers

(1-(PYRIDIN-2-YL)CYCLOHEXYL)METHANAMINE 95.00% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

Useful:

• Canonical SMILES: C1CCC(CC1)(CN)C2=CC=CC=N2

Technology Process of [1-(2-Pyridinyl)cyclohexyl]methanamine

There total 5 articles about [1-(2-Pyridinyl)cyclohexyl]methanamine 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%

→ 1-aminomethyl-1-(pyridin-2-yl)cyclohexane (204067-08-3)

Guidance literature:

Reference yield: 87.0%

1-(pyridin-2-yl)cyclohexanecarbonitrile (204067-32-3) → 1-aminomethyl-1-(pyridin-2-yl)cyclohexane (204067-08-3)

Guidance literature:

With ammonia; hydrogen; potassium hydroxide; In ethanol; at 50 ℃; for 15h; Autoclave;

DOI:10.1016/j.bmc.2014.12.007

Reference yield:

pyridine-2-acetonitrile (2739-97-1) → 1-aminomethyl-1-(pyridin-2-yl)cyclohexane (204067-08-3)

Guidance literature:

Multi-step reaction with 2 steps

1: sodium hydride / diethyl ether; dimethyl sulfoxide; mineral oil / 25 h / 15 - 20 °C / Inert atmosphere

2: ammonia; hydrogen; potassium hydroxide / ethanol / 15 h / 50 °C / Autoclave

With ammonia; hydrogen; sodium hydride; potassium hydroxide; In diethyl ether; ethanol; dimethyl sulfoxide; mineral oil;

DOI:10.1016/j.bmc.2014.12.007

upstream raw materials:

pyridine-2-acetonitrile

1,5-dibromo-pentane

1-(pyridin-2-yl)cyclohexanecarbonitrile

Downstream raw materials:

(S)-3-(1H-indol-3-yl)-N-[1-(pyridin-2-yl)cyclohexylmethyl]-2-[(4-nitrophenyl)-carbamoylamino]propanamide

(R)-3-(1H-indol-3-yl)-N-[1-(pyridin-2-yl)cyclohexylmethyl]-2-[(4-nitrophenyl)-carbamoylamino]propanamide

Refernces

• 1、 -. "FUSED [1,2,4]THIADIAZINE DERIVATIVES WHICH ACT AS KAT INHIBITORS OF THE MYST FAMILY". Page/Page column 90. . Retrieved 2019/03/17.