structure of (4-Aminopiperidin-1-yl)(2,3-dihydrobenzo[b][1,4]dioxin-2-yl)methanone

(4-Aminopiperidin-1-yl)(2,3-dihydrobenzo[b][1,4]dioxin-2-yl)methanone

CAS No.: 1000931-36-1
M. Wt: 262.30
M. Fa: C14H18N2O3
InChI Key: NTJRIKIDGGEIGE-UHFFFAOYSA-N

Names and Identifiers of 1000931-36-1

CAS Number

1000931-36-1

MDL Number

MFCD09802161

IUPAC Name

1-(2,3-dihydro-1,4-benzodioxine-2-carbonyl)piperidin-4-amine

InChI

InChI=1S/C14H18N2O3/c15-10-5-7-16(8-6-10)14(17)13-9-18-11-3-1-2-4-12(11)19-13/h1-4,10,13H,5-9,15H2

InChIKey

NTJRIKIDGGEIGE-UHFFFAOYSA-N

Canonical SMILES

NC1CCN(C(=O)C2COC3=CC=CC=C3O2)CC1

UNSPSC Code

12352100

Physical and chemical properties of 1000931-36-1

Boiling Point

447.6±45.0 °C at 760 mmHg

H Bond Acceptors

4

H Bond Donors

1

LogP

0.027905251

Molecular Formula

C14H18N2O3

Molecular Weight

262.30

Storage condition

2-8°C, protect from light

Safety Information of 1000931-36-1

Pictograms

Signal Word

 Warning

Safety Data Sheet
Supports customized editing of SDS information and downloading in PDF documents.

Applications of 1000931-36-1

The applications of 1-(2,3-Dihydro-1,4-benzodioxine-2-carbonyl)piperidin-4-amine are broad and include:

  • Pharmaceutical development: As a potential lead compound for drugs targeting metabolic disorders or neurodegenerative diseases.
  • Research tools: Utilized in biochemical assays to study enzyme activity or cellular processes.
  • Chemical probes: For investigating biological pathways involving neurotransmitters or metabolic enzymes.

Interaction Studies of 1000931-36-1

Interaction studies reveal that this compound may interact with various biological targets:

  • Enzyme interactions: The compound's ability to inhibit specific enzymes has been documented, suggesting a mechanism for its biological effects.
  • Receptor binding studies: Investigations into its affinity for neurotransmitter receptors could elucidate its potential neuroprotective effects.
  • Molecular docking studies: Computational approaches have been employed to predict binding affinities and interaction modes with target proteins.

These studies help in understanding the pharmacodynamics of the compound and guide further development.

Biological Activity of 1000931-36-1

Compounds featuring the 1,4-benzodioxane scaffold are known for their diverse biological activities, including:

  • Enzyme inhibition: Studies have shown that derivatives of benzodioxane exhibit inhibitory effects on enzymes such as α-glucosidase and acetylcholinesterase.
  • Anticancer properties: Some benzodioxane derivatives have demonstrated potential in cancer treatment through various mechanisms, including apoptosis induction and cell cycle arrest.
  • Neuroprotective effects: Certain compounds in this class have been explored for their neuroprotective properties, possibly due to their ability to modulate neurotransmitter systems.