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3-(2-Methyl-1H-imidazol-1-yl)propan-1-amine

  • CAS No. 2258-21-1

  • Cat. No. CS-0152772
  • Molecule weight139.20
  • Purity≥95%
  • MDL No.MFCD00272462

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

3-(2-Methyl-1H-imidazol-1-yl)propan-1-amine|CS-0152772

Structure of 2258-21-1

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General Information

  • CAS No. 2258-21-1
  • Cat. No. CS-0152772
  • Purity ≥95%
  • MDL No. MFCD00272462
  • Storage 4°C, protect from light
  • Shipping Room temperature in continental US; may vary elsewhere.
  • Molecular Formula C₇H₁₃N₃
  • Molecular Weight 139.20
  • Synonym(s) 3-(2-METHYL-IMIDAZOL-1-YL)-PROPYLAMINE
  • SMILES CC1=NC=CN1CCCN

Description

3-(2-Methyl-1H-imidazol-1-yl)propan-1-amine features a polar amine tail linked to a sterically accessible imidazole ring, enabling versatile coordination in catalytic systems. This bench-stable scaffold integrates readily into ligand frameworks for transition metal catalysis, offering enhanced solubility and tunable electronic properties in aqueous and organic media.

Application

3-(2-Methyl-1H-imidazol-1-yl)propan-1-amine serves as a versatile bifunctional building block, enabling efficient construction of imidazole-containing scaffolds in medicinal chemistry. The primary amine facilitates conjugation reactions, while the 2-methylimidazole moiety provides a stable, electron-rich heterocyclic handle compatible with diverse coupling and functionalization strategies. Its bench-stable nature and clean purification profile support scalable synthesis and downstream derivatization in API development workflows.

Synthesis

  • Route1
    • 2-Chloropropan-1-amine hydrochloride|CS-0668764
      6266-35-9
    • ~50%
    • In-stock
      3-(2-Methyl-1H-imidazol-1-yl)propan-1-amine|CS-0152772
      2258-21-1

    References

    • AMR Technology, Inc. Patent: US2006/183769 A1, 2006 ; Location in patent: Page/Page column 6 ;
  • Route2
    • null|null
      101225-81-4
    • ~%
    • In-stock
      3-(2-Methyl-1H-imidazol-1-yl)propan-1-amine|CS-0152772
      2258-21-1

    References

    • WO2007/77510 A2, ; Page/Page column 32 ; WO 2007/077510 A2
  • Route3

    References

    • Journal of Medicinal Chemistry, , vol. 29, # 4 p. 523 - 530

Safety Information

Download SDS
GHS Pictogram :
GHS No : GHS05,GHS07
Signal Word : Danger
UN#: 2735
Class : 8
Packing Group : Ⅱ
Hazard Statements : H302-H314
Precautionary Statements : P260-P264-P270-P280-P301+P330+P331-P304+P340-P330-P363-P405-P501

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Computational Chemistry Data

  • TPSA   43.84
  • LogP   0.54032
  • H_Acceptors   3
  • H_Donors   1
  • Rotatable_Bonds   3

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