(2-(Pyrrolidin-1-yl)pyridin-3-yl)methanamine

Base Information

• Chemical Name: (2-(Pyrrolidin-1-yl)pyridin-3-yl)methanamine
• CAS No.: 859850-79-6
• Molecular Formula: C10H15 N3
• Molecular Weight: 177.249
• Hs Code.: 2933990090
• European Community (EC) Number: 801-724-7
• DSSTox Substance ID: DTXSID80588614
• Wikidata: Q72505494
• Mol file: 859850-79-6.mol

Synonyms:859850-79-6;(2-(Pyrrolidin-1-yl)pyridin-3-yl)methanamine;(2-pyrrolidin-1-ylpyrid-3-yl)methylamine;(2-pyrrolidin-1-ylpyridin-3-yl)methanamine;1-[2-(Pyrrolidin-1-yl)pyridin-3-yl]methanamine;[2-(pyrrolidin-1-yl)pyridin-3-yl]methanamine;[2-(1-Pyrrolidinyl)-3-pyridinyl]methanamine;SCHEMBL3287105;DTXSID80588614;MFCD08690249;RB3335;AKOS000150823;SB53998;AS-66253;DB-076517;EN300-239652;J-500534;F2147-1537;V7X

Chemical Property of (2-(Pyrrolidin-1-yl)pyridin-3-yl)methanamine

Chemical Property:

• Vapor Pressure: 7.48E-05mmHg at 25°C
• Refractive Index: 1.589
• Boiling Point: 342.5°C at 760 mmHg
• Flash Point: 161°C
• PSA: 42.15000
• Density: 1.127g/cm³
• LogP: 1.90580
• Storage Temp.: under inert gas (nitrogen or Argon) at 2–8 °C
• XLogP3: 0.7
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 2
• Exact Mass: 177.126597491
• Heavy Atom Count: 13
• Complexity: 154

Purity/Quality:

97% ^*data from raw suppliers

(2-(Pyrrolidin-1-yl)pyridin-3-yl)methanamine 95% ^*data from reagent suppliers

Safty Information:

• Statements: 20/21/22-34
• Safety Statements: 23-26-36/37/39-45

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CCN(C1)C2=C(C=CC=N2)CN
• Uses: (2-(pyrrolidin-1-yl)pyridin-3-yl)methanamine (cas# 859850-79-6) is a pyrazine-based blockers of Nav1.8 sodium channel.

Technology Process of (2-(Pyrrolidin-1-yl)pyridin-3-yl)methanamine

There total 2 articles about (2-(Pyrrolidin-1-yl)pyridin-3-yl)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:

2-(pyrrolidin-1-yl)nicotinonitrile (59025-38-6) → C-(2-pyrrolidin-1-yl-pyridin-3-yl)-methylamine (859850-79-6)

Guidance literature:

With ammonia; hydrogen; Raney nickel; In methanol; at 20 ℃; for 2h; under 3102.97 Torr;

Reference yield:

3-cyano-2-fluoropyridine (3939-13-7) → C-(2-pyrrolidin-1-yl-pyridin-3-yl)-methylamine (859850-79-6)

Guidance literature:

Multi-step reaction with 2 steps

1: triethylamine / tetrahydrofuran / 0.5 h / 0 - 20 °C

2: ammonia; hydrogen / nickel / methanol / 2 h / 20 °C / 3102.97 Torr

With ammonia; hydrogen; triethylamine; nickel; In tetrahydrofuran; methanol;

Reference yield: 86.0%

C-(2-pyrrolidin-1-yl-pyridin-3-yl)-methylamine (859850-79-6) + 2,3-dichloro-1-isothiocyanatobenzene (6590-97-2) → 1-(2,3-dichloro-phenyl)-3-(2-pyrrolidin-1-yl-pyridin-3-ylmethyl)-thiourea

Guidance literature:

nickel; In tetrahydrofuran; at 20 ℃;

upstream raw materials:

2-(pyrrolidin-1-yl)nicotinonitrile

3-cyano-2-fluoropyridine

Downstream raw materials:

N-((2-pyrrolidin-1-yl-pyridin-3-yl)methyl)-6-(4-chlorophenyl)-pyrazine-2-carboxamide