[1-(1-benzofuran-2-yl)ethyl](methyl)amine
CAS No.:
100127-74-0
M. Wt:
175.22700
M. Fa:
C11H13NO
InChI Key:
JLKRQCDKFNFEIQ-UHFFFAOYSA-N
Names and Identifiers of 100127-74-0
CAS Number |
100127-74-0 |
|---|---|
MDL Number |
MFCD09813144 |
IUPAC Name |
[1-(1-benzofuran-2-yl)ethyl](methyl)amine |
InChI |
InChI=1S/C11H13NO/c1-8(12-2)11-7-9-5-3-4-6-10(9)13-11/h3-8,12H,1-2H3 |
InChIKey |
JLKRQCDKFNFEIQ-UHFFFAOYSA-N |
Canonical SMILES |
CNC(C)C1=CC2=CC=CC=C2O1 |
UNSPSC Code |
12352100 |
Physical and chemical properties of 100127-74-0
Exact Mass |
175.10000 |
|---|---|
H Bond Acceptors |
1 |
H Bond Donors |
1 |
LogP |
3.10410 |
Molecular Formula |
C11H13NO |
Molecular Weight |
175.22700 |
PSA |
25.17000 |
Safety Information of 100127-74-0
Applications of 100127-74-0
The applications of amine span various fields:
- Pharmaceutical Development: Its unique structure makes it a candidate for developing new drugs targeting neurological disorders.
- Chemical Probes: Used in research to study receptor interactions and signaling pathways.
- Material Science: Potential applications in creating novel materials with specific electronic or optical properties due to its organic nature.
Interaction Studies of 100127-74-0
Interaction studies involving amine focus on its binding affinity and activity against various biological targets:
- Receptor Binding Assays: These studies assess how well the compound binds to neurotransmitter receptors, which is crucial for understanding its potential therapeutic effects.
- In Vitro Studies: Evaluating the compound's effects on cell lines can provide insights into its mechanism of action and toxicity profiles.
- Computational Modeling: Molecular docking studies help predict how this compound interacts with target proteins at the molecular level, guiding further experimental designs.
Biological Activity of 100127-74-0
Research indicates that compounds similar to amine exhibit various biological activities, including:
- Neuroprotective Effects: Some benzofuran derivatives have shown promise in protecting neuronal cells against oxidative stress.
- Antidepressant Activity: Certain analogs have been evaluated for their potential antidepressant effects, possibly through modulation of neurotransmitter systems.
- Antimicrobial Properties: Compounds featuring similar structures have demonstrated antibacterial and antifungal activities, making them candidates for further pharmacological studies.
