structure of 5-(tetrahydro-2H-pyran-4-yl)-1H-pyrazol-3-amine

5-(tetrahydro-2H-pyran-4-yl)-1H-pyrazol-3-amine

CAS No.: 1000896-69-4
M. Wt: 167.20800
M. Fa: C8H13N3O
InChI Key: AQPGNHFZFXIMJB-UHFFFAOYSA-N
Appearance: white solid

Names and Identifiers of 1000896-69-4

CAS Number

1000896-69-4

EC Number

820-725-3

MDL Number

MFCD20502055

IUPAC Name

5-(oxan-4-yl)-1H-pyrazol-3-amine

InChI

InChI=1S/C8H13N3O/c9-8-5-7(10-11-8)6-1-3-12-4-2-6/h5-6H,1-4H2,(H3,9,10,11)

InChIKey

AQPGNHFZFXIMJB-UHFFFAOYSA-N

Canonical SMILES

C1COCCC1C2=CC(=NN2)N

UNSPSC Code

12352100

Physical and chemical properties of 1000896-69-4

Acidity coefficient

15.27±0.10(Predicted)

Boiling Point

411.2±40.0 °C(Predicted)

Density

1.233±0.06 g/cm3(Predicted)

Exact Mass

167.10600

LogP

1.46710

Molecular Formula

C8H13N3O

Molecular Weight

167.20800

PSA

63.93000

Storage condition

2-8°C

Safety Information of 1000896-69-4

Pictograms

Signal Word

 Warning

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

Applications of 1000896-69-4

5-(Tetrahydro-2H-pyran-4-yl)-1H-pyrazol-3-amine has several applications across various fields:

  • Chemistry: Used as a building block for synthesizing more complex organic molecules.
  • Biology: Investigated for its potential biological activities, including antimicrobial and anticancer properties.
  • Medicine: Explored as a therapeutic agent in treating various diseases.
  • Industry: Applied in developing new materials and as a catalyst in certain

Interaction Studies of 1000896-69-4

The mechanism of action for 5-(tetrahydro-2H-pyran-4-yl)-1H-pyrazol-3-amine involves its binding to specific enzymes or receptors, which may alter their activity. Studies have shown that its structural features contribute to its effectiveness in modulating biological pathways, making it a candidate for further research into its therapeutic potential.

Biological Activity of 1000896-69-4

Research indicates that 5-(tetrahydro-2H-pyran-4-yl)-1H-pyrazol-3-amine has potential biological activities, particularly in the fields of antimicrobial and anticancer research. The compound's interaction with specific molecular targets may alter enzyme or receptor activity, leading to various therapeutic effects. Its unique structure enables it to act as a building block for more complex molecules in medicinal chemistry.

Physical sample testing spectrum (NMR) of 1000896-69-4

Physical sample testing spectrum (NMR) of 1000896-69-4