1-Methyl-4,5,6,7-tetrahydro-1H-pyrrolo[3,2-C]pyridine

Base Information

• Chemical Name: 1-Methyl-4,5,6,7-tetrahydro-1H-pyrrolo[3,2-C]pyridine
• CAS No.: 569351-26-4
• Molecular Formula: C8H12N2
• Molecular Weight: 136.197
• DSSTox Substance ID: DTXSID70450735
• Wikidata: Q82270541
• Mol file: 569351-26-4.mol

Synonyms:569351-26-4;1-METHYL-4,5,6,7-TETRAHYDRO-1H-PYRROLO[3,2-C]PYRIDINE;1-methyl-4,5,6,7-tetrahydropyrrolo[3,2-c]pyridine;1-Methyl-4,5,6,7-tetrahydro-5-azaindole;MFCD08236856;1-METHYL-1H,4H,5H,6H,7H-PYRROLO[3,2-C]PYRIDINE;SCHEMBL2261217;DTXSID70450735;AKOS006285765;AB44186;AS-39389;SY021320;CS-0342495;FT-0751500;EN300-1601065

Chemical Property of 1-Methyl-4,5,6,7-tetrahydro-1H-pyrrolo[3,2-C]pyridine

Chemical Property:

• PSA: 16.96000
• LogP: 0.99960
• XLogP3: 0.1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 0
• Exact Mass: 136.100048391
• Heavy Atom Count: 10
• Complexity: 124

Purity/Quality:

97% ^*data from raw suppliers

1-Methyl-4,5,6,7-tetrahydro-1H-pyrrolo[3,2-c]pyridine 96% ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CN1C=CC2=C1CCNC2

Technology Process of 1-Methyl-4,5,6,7-tetrahydro-1H-pyrrolo[3,2-C]pyridine

There total 6 articles about 1-Methyl-4,5,6,7-tetrahydro-1H-pyrrolo[3,2-C]pyridine 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: 49.0%

→ 1-methyl-4,5,6,7-tetrahydro-1H-pyrrolo[3,2-c]pyridine (569351-26-4)

Guidance literature:

With methanol; sodium tetrahydroborate; at 20 ℃; for 2h;

Reference yield:

1-methyl-6,7-dihydro-1H-pyrrolo[3,2-c]pyridine (569351-25-3) → 1-methyl-4,5,6,7-tetrahydro-1H-pyrrolo[3,2-c]pyridine (569351-26-4)

Guidance literature:

With sodium tetrahydroborate; In methanol; water; for 1h;

DOI:10.1021/jm030080s

Reference yield:

N-methylpyrrole aldehyde (1192-58-1) → 1-methyl-4,5,6,7-tetrahydro-1H-pyrrolo[3,2-c]pyridine (569351-26-4)

Guidance literature:

Multi-step reaction with 5 steps

1: 75 percent / NaOAc / 1.5 h / Heating

2: 69 percent / LiAlH₄ / tetrahydrofuran / 5 h / 20 °C

3: 60 percent / 7 h / Heating

4: 36 percent / POCl₃ / toluene / 3 h / Heating

5: 0.23 g / NaBH₄ / H₂O; methanol / 1 h

With sodium tetrahydroborate; lithium aluminium tetrahydride; sodium acetate; trichlorophosphate; In tetrahydrofuran; methanol; water; toluene;

DOI:10.1021/jm030080s

upstream raw materials:

1-methyl-6,7-dihydro-1H-pyrrolo[3,2-c]pyridine

N-methylpyrrole aldehyde

2-(2-Aminoethyl)-1-methylpyrrole

1-methyl-2-(E-2-nitroethenyl)-1H-pyrrole

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