Cas no 3221-17-8 (2-(4-Propylpiperazin-1-yl)ethanol)

2-(4-Propylpiperazin-1-yl)ethanol is a versatile organic compound featuring both piperazine and ethanol functional groups, making it valuable as an intermediate in pharmaceutical and chemical synthesis. Its structure allows for further derivatization, enabling applications in drug development, particularly for CNS-targeting agents and receptor modulators. The propyl substitution enhances lipophilicity, potentially improving membrane permeability in bioactive molecules. This compound is characterized by its stability under standard conditions and compatibility with common synthetic procedures. Its balanced polarity facilitates purification and handling, while the reactive hydroxyl group offers a convenient site for further functionalization. The piperazine moiety contributes to molecular recognition properties, making it useful in medicinal chemistry research.
2-(4-Propylpiperazin-1-yl)ethanol structure
3221-17-8 structure
Product Name:2-(4-Propylpiperazin-1-yl)ethanol
CAS No:3221-17-8
MF:C9H20N2O
MW:172.267902374268
CID:295129
PubChem ID:21462312
Update Time:2025-05-19

2-(4-Propylpiperazin-1-yl)ethanol Chemical and Physical Properties

Names and Identifiers

    • 2-(4-Propylpiperazin-1-yl)ethanol
    • 1-Piperazineethanol,4-propyl-
    • 1-Piperazineethanol,4-propyl-(7CI,8CI,9CI)
    • Z425794000
    • AB01329067-02
    • 3221-17-8
    • SCHEMBL3629456
    • 4-Propyl-1-piperazineethanol
    • DTXSID90614276
    • NCGC00337220-01
    • 2-(4-Propylpiperazin-1-yl)ethan-1-ol
    • 4-(2-hydroxyethyl)-piperazin-1-propane
    • Inchi: 1S/C9H20N2O/c1-2-3-10-4-6-11(7-5-10)8-9-12/h12H,2-9H2,1H3
    • InChI Key: JJVDPWJWBAAPGG-UHFFFAOYSA-N
    • SMILES: OCCN1CCN(CCC)CC1

Computed Properties

  • Exact Mass: 172.1577
  • Monoisotopic Mass: 172.157563266g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 4
  • Complexity: 111
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 0.3
  • Topological Polar Surface Area: 26.7?2

Experimental Properties

  • PSA: 26.71
  • LogP: -0.11790

2-(4-Propylpiperazin-1-yl)ethanol Pricemore >>

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Additional information on 2-(4-Propylpiperazin-1-yl)ethanol

2-(4-Propylpiperazin-1-yl)ethanol (CAS No. 3221-17-8): A Comprehensive Overview

2-(4-Propylpiperazin-1-yl)ethanol, also known by its CAS registry number 3221-17-8, is a chemical compound that has garnered significant attention in the fields of organic chemistry and pharmacology. This compound is a derivative of piperazine, a six-membered ring containing two nitrogen atoms, and is characterized by its unique structure and versatile applications. In recent years, advancements in synthetic methodologies and its potential therapeutic applications have made 2-(4-propylpiperazin-1-yl)ethanol a focal point for researchers worldwide.

The molecular structure of 2-(4-propylpiperazin-1-yl)ethanol consists of a piperazine ring substituted with a propyl group at the 4-position and an ethanol group at the 1-position. This arrangement imparts the compound with distinct physicochemical properties, including moderate solubility in water and high stability under standard conditions. The compound's structure also facilitates its use in various chemical reactions, such as nucleophilic substitutions and condensations, making it a valuable intermediate in organic synthesis.

Recent studies have explored the potential of 2-(4-propylpiperazin-1-yl)ethanol in drug discovery. Its piperazine backbone is known to exhibit bioactivity, particularly in interactions with GABA receptors, which are critical targets for antiepileptic and anxiolytic agents. Researchers have reported that derivatives of this compound demonstrate promising activity in preclinical models of epilepsy and anxiety, suggesting its potential as a lead compound for therapeutic development.

In addition to its pharmacological applications, 2-(4-propylpiperazin-1-yl)ethanol has found utility in the synthesis of advanced materials. Its ability to form stable complexes with metal ions has led to its use in coordination chemistry and the development of metalloorganic frameworks (MOFs). Recent breakthroughs in this area have highlighted its role in enhancing the catalytic efficiency of MOFs, which are widely used in gas storage, separation, and catalysis.

The synthesis of 2-(4-propylpiperazin-1-yl)ethanol has also been optimized through green chemistry approaches. Traditional methods often involved multi-step reactions with low yields and high environmental impact. However, recent advancements have introduced more efficient protocols, such as one-pot synthesis using microwave-assisted techniques. These methods not only improve yield but also reduce reaction time and energy consumption, aligning with sustainable chemical practices.

From an analytical standpoint, modern spectroscopic techniques have provided deeper insights into the structural properties of 2-(4-propylpiperazin-1-yl)ethanol. High-resolution mass spectrometry (HRMS) and nuclear magnetic resonance (NMR) spectroscopy have been instrumental in confirming its molecular formula (C9H19N2O) and elucidating its stereochemistry. These findings are crucial for ensuring the accuracy of synthetic procedures and maintaining quality control in industrial production.

Looking ahead, the future of 2-(4-propylpiperazin-1-yl)ethanol appears promising as researchers continue to uncover its diverse applications. Its role as a building block in medicinal chemistry, coupled with its potential in materials science, positions it as a key compound for interdisciplinary research. As technological advancements continue to refine synthetic methods and expand application horizons, 2-(4-propylpiperazin-1-yethyl) will undoubtedly remain a subject of interest for both academia and industry.

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