1-Methylpiperidine-2-carbaldehyde

Base Information

• Chemical Name: 1-Methylpiperidine-2-carbaldehyde
• CAS No.: 41467-01-0
• Molecular Formula: C7H13NO
• Molecular Weight: 127.186
• Hs Code.: 2933399090
• DSSTox Substance ID: DTXSID70550880
• Mol file: 41467-01-0.mol

Synonyms:41467-01-0;1-Methyl-piperidine-2-carbaldehyde;1-METHYLPIPERIDINE-2-CARBALDEHYDE;1-Methyl-2-piperidinecarboxaldehyde (>80%);SCHEMBL88583;DTXSID70550880;HBQKERHWQDYYEM-UHFFFAOYSA-N;MFCD09744984;AKOS011948132;SB42269;AM100803;SY234138

Chemical Property of 1-Methylpiperidine-2-carbaldehyde

Chemical Property:

• PSA: 20.31000
• LogP: 0.60750
• XLogP3: 0.7
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 1
• Exact Mass: 127.099714038
• Heavy Atom Count: 9
• Complexity: 103

Purity/Quality:

97% ^*data from raw suppliers

1-Methyl-2-piperidinecarboxaldehyde ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CN1CCCCC1C=O
• Uses: 1-Methyl-2-piperidinecarboxaldehyde is derived from 1-Methyl-2-piperidinemethanol (M328110), which is used as a reagent to synthesize phenylpyridone derivatives, compounds that act as anti-obesity agents in mice.

Technology Process of 1-Methylpiperidine-2-carbaldehyde

There total 10 articles about 1-Methylpiperidine-2-carbaldehyde 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: 65.0%

2-(1,3-dioxolan-2-yl)-1-methylpiperidine (112391-00-1) → N-methylpiperidine-2-carboxaldehyde (41467-01-0)

Guidance literature:

With sulfuric acid; at 80 ℃; for 40h;

Reference yield: 55.0%

(2-(4-Chlorophenyl)quinolin-4-yl) (piperidin-2-yl)methanone → N-methylpiperidine-2-carboxaldehyde (41467-01-0) + 2-(4-chlorophenyl)quinolin-4-yl

Guidance literature:

In dichloromethane;

Reference yield: 31.0%

(1-methyl-piperidin-2-yl)-methanol (20845-34-5) → N-methylpiperidine-2-carboxaldehyde (41467-01-0)

Guidance literature:

(1-methyl-piperidin-2-yl)-methanol; With oxalyl dichloride; dimethyl sulfoxide; In dichloromethane; for 0.75h; Cooling with dry ice;

With triethylamine; In dichloromethane; at 20 ℃; for 1.17h; Cooling with dry ice;

upstream raw materials:

2-(1,3-dioxolan-2-yl)-1-methylpiperidine

(1-methyl-piperidin-2-yl)-methanol

pyridine-2-carbaldehyde

2-(1,3-dioxolan-2-yl)pyridine

Downstream raw materials:

N-(3-chloro-4-fluorophenyl)-7-[(2E)-3-(1-methylpiperidin-2-yl)prop-2-enoyl]-5,6,7,8-tetrahydropyrido[4',3':4,5]thieno[2,3-d]pyrimidin-4-amine

(E)-N-[4-[[3-chloro-4-(pyridin-2-ylmethoxy)phenyl]amino]-3-cyano-7-ethoxy-6-quinolinyl]-3-(1-methyl-2-piperidinyl)prop-2-enoylamine