2-Piperidin-1-yl-pyrimidine-5-carbaldehyde

Base Information

• Chemical Name: 2-Piperidin-1-yl-pyrimidine-5-carbaldehyde
• CAS No.: 149806-11-1
• Molecular Formula: C10H13 N3 O
• Molecular Weight: 191.233
• Hs Code.: 2933990090
• DSSTox Substance ID: DTXSID10390287
• Wikidata: Q72500980
• ChEMBL ID: CHEMBL4457972
• Mol file: 149806-11-1.mol

Synonyms:149806-11-1;2-Piperidin-1-yl-pyrimidine-5-carbaldehyde;2-(piperidin-1-yl)pyrimidine-5-carbaldehyde;2-piperidin-1-ylpyrimidine-5-carbaldehyde;2-(1-PIPERIDINYL)-5-PYRIMIDINECARBALDEHYDE;SCHEMBL1134095;CHEMBL4457972;DTXSID10390287;CDYSOZHCSGJKEP-UHFFFAOYSA-N;MFCD06589847;AKOS000283905;AB25346;BS-21516;BB 0237084;CS-0208351;FT-0748804;A18223;EN300-725631;2-(piperidin-1-yl)pyrimidine-5-carbaldehyde, AldrichCPR

Chemical Property of 2-Piperidin-1-yl-pyrimidine-5-carbaldehyde

Chemical Property:

• Vapor Pressure: 0mmHg at 25°C
• Refractive Index: 1.591
• Boiling Point: 374.548°C at 760 mmHg
• Flash Point: 180.32°C
• PSA: 46.09000
• Density: 1.197g/cm³
• LogP: 1.34440
• XLogP3: 1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 2
• Exact Mass: 191.105862047
• Heavy Atom Count: 14
• Complexity: 184

Purity/Quality:

97% ^*data from raw suppliers

2-(Piperidin-1-yl)pyrimidine-5-carbaldehyde ^*data from reagent suppliers

Safty Information:

• Hazard Codes: Xi,Xn
• Statements: 22

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1CCN(CC1)C2=NC=C(C=N2)C=O

Technology Process of 2-Piperidin-1-yl-pyrimidine-5-carbaldehyde

There total 1 articles about 2-Piperidin-1-yl-pyrimidine-5-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:

N,N-dimethyl-formamide (68-12-2,33513-42-7) + 5-bromo-2-(piperidin-1-yl)pyrimidine (57356-64-6) → 2-(piperidin-1-yl)pyrimidine-5-carbaldehyde (149806-11-1)

Guidance literature:

5-bromo-2-(piperidin-1-yl)pyrimidine; With n-butyllithium; In tetrahydrofuran; hexanes; at -78 - -70 ℃; for 1h;

N,N-dimethyl-formamide; In tetrahydrofuran; hexanes; at -70 ℃; for 1h;

Reference yield:

2-(piperidin-1-yl)pyrimidine-5-carbaldehyde (149806-11-1) + 4-fluoroaniline (371-40-4) → (4-fluoro-phenyl)-(2-piperidin-1-yl-pyrimidin-5-ylmethyl)-amine (1033619-89-4)

Guidance literature:

2-(piperidin-1-yl)pyrimidine-5-carbaldehyde; 4-fluoroaniline; In dichloromethane; acetic acid; at 20 ℃; for 0.5h;

With sodium tris(acetoxy)borohydride; In dichloromethane; acetic acid; at 20 ℃; for 1h;

upstream raw materials:

N,N-dimethyl-formamide

5-bromo-2-(piperidin-1-yl)pyrimidine

Downstream raw materials:

(4-fluoro-phenyl)-(2-piperidin-1-yl-pyrimidin-5-ylmethyl)-amine

Refernces

• 1、 -. "ION CHANNEL MODULATORS". Page/Page column 84; 104-105. . Retrieved 2008/12/06.
• 2、 -. "CARBOXAMIDE DERIVATIVES AS ION CHANNEL MODULATORS". Page/Page column 82; 106-107. . Retrieved 2008/12/06.