structure of 1-Amino-2-phenylpentan-2-ol

1-Amino-2-phenylpentan-2-ol

CAS No.: 100054-37-3
M. Wt: 179.25900
M. Fa: C11H17NO
InChI Key: CUQIXSHMVVABAI-UHFFFAOYSA-N

Names and Identifiers of 1-Amino-2-phenylpentan-2-ol

CAS Number

100054-37-3

MDL Number

MFCD17219198

IUPAC Name

1-amino-2-phenylpentan-2-ol

InChI

InChI=1S/C11H17NO/c1-2-8-11(13,9-12)10-6-4-3-5-7-10/h3-7,13H,2,8-9,12H2,1H3

InChIKey

CUQIXSHMVVABAI-UHFFFAOYSA-N

Canonical SMILES

CCCC(CN)(C1=CC=CC=C1)O

UNSPSC Code

12352100

Physical and chemical properties of 1-Amino-2-phenylpentan-2-ol

Exact Mass

179.13100

H Bond Acceptors

2

H Bond Donors

2

LogP

2.33330

Molecular Formula

C11H17NO

Molecular Weight

179.25900

PSA

46.25000

Safety Information of 1-Amino-2-phenylpentan-2-ol

Pictograms

Signal Word

 Warning

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

Applications of 1-Amino-2-phenylpentan-2-ol

1-Amino-2-phenylpentan-2-ol has several applications:

  • Pharmaceutical Development: Its role as a β-secretase inhibitor positions it as a candidate for drugs targeting Alzheimer's disease.
  • Chemical Research: It serves as a building block in organic synthesis and medicinal chemistry for developing new therapeutic agents.

Interaction Studies of 1-Amino-2-phenylpentan-2-ol

Studies investigating the interactions of 1-Amino-2-phenylpentan-2-ol with biological targets have highlighted its potential as a selective inhibitor of β-secretase enzymes. The presence of specific substituents on the phenyl ring enhances binding affinity and selectivity towards these enzymes, making it a focus of research in neuropharmacology.

Biological Activity of 1-Amino-2-phenylpentan-2-ol

Research indicates that 1-Amino-2-phenylpentan-2-ol exhibits potential biological activity, particularly as an inhibitor of β-secretase enzymes, which are implicated in Alzheimer's disease. In studies, derivatives of this compound have shown selective inhibition of human β-secretase 1 and 2, suggesting its relevance in neurodegenerative disease research. Additionally, its structural properties may contribute to interactions with various biological targets.