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CS-W001157 4
Total: USD 88.00

2-(4-Methyl-1-piperazinyl)aniline

  • CAS No. 180605-36-1

  • Cat. No. CS-W003132
  • Purity≥98%
  • MDL No.MFCD04035359

*For research and further manufacturing use only, not for direct human use.

2-(4-Methyl-1-piperazinyl)aniline|CS-W003132

Structure of 180605-36-1

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General Information

  • CAS No. 180605-36-1
  • Cat. No. CS-W003132
  • Purity ≥98%
  • MDL No. MFCD04035359
  • Storage 4°C, protect from light
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₁₁H₁₇N₃
  • Molecular Weight 191.27
  • Synonym(s) ART-CHEM-BB B021944
  • SMILES CN1CCN(C2=CC=CC=C2N)CC1

Description

2-(4-Methyl-1-piperazinyl)aniline features a piperazine ring fused to an aromatic amine, delivering enhanced solubility and metabolic stability. This scaffold integrates readily into bioactive molecules, serving as a key building block in pharmaceutical intermediates and kinase inhibitor development.

Application

2-(4-Methyl-1-piperazinyl)aniline serves as a versatile building block in medicinal chemistry, enabling the construction of bioactive heterocycles and drug candidates. Its aniline functionality facilitates Suzuki and Buchwald–Hartwig couplings, while the piperazine ring offers tunable basicity and solubility. The methylated piperazine enhances metabolic stability and functional group tolerance, supporting efficient synthesis and purification in multi-step campaigns.

Synthesis

  • Route1
    • 1-Methyl-4-(2-nitrophenyl)piperazine|CS-0877268
      62208-63-3
    • ~99%
    • In-stock
      2-(4-Methyl-1-piperazinyl)aniline|CS-W003132
      180605-36-1

    References

    • Bioorganic and Medicinal Chemistry Letters, , vol. 20, # 17 p. 5221 - 5224
  • Route2

    References

    • WO2013/55949 A2, ;

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS05,GHS07
Signal Word : Danger
UN#: 3263
Class : 8
Packing Group : Ⅲ
Hazard Statements : H302-H314
Precautionary Statements : P260-P264-P270-P280-P301+P330+P331-P303+P361+P353-P304+P340-P305+P351+P338-P330-P363-P405-P501

Quality Control

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Computational Chemistry Data

  • TPSA   32.5
  • LogP   1.0206
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   1

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