About 2-(8-aminoquinolin-5-yl)oxyacetamide
2-(8-aminoquinolin-5-yl)oxyacetamide (PubChem CID 116524742) has the molecular formula C11H11N3O2
and a molecular weight of 217.23 g/mol. Its IUPAC name is 2-(8-aminoquinolin-5-yl)oxyacetamide.
Molecular Properties
| Compound Name | 2-(8-aminoquinolin-5-yl)oxyacetamide |
| PubChem CID | 116524742 |
| Molecular Formula | C11H11N3O2 |
| Molecular Weight | 217.23 g/mol |
| Exact Mass | 217.09 |
| IUPAC Name | 2-(8-aminoquinolin-5-yl)oxyacetamide |
| SMILES | NC(=O)COc1ccc(N)c2ncccc12 |
| InChI | InChI=1S/C11H11N3O2/c12-8-3-4-9(16-6-10(13)15)7-2-1-5-14-11(7)8/h1-5H,6,12H2,(H2,13,15) |
| InChIKey | RDGPNXLYFMTQMP-UHFFFAOYSA-N |
| XLogP | 0.68 |
| TPSA | 91.23 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 16 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 217.23 |
| LogP ≤ 5 | 0.68 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 4 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'aniline', 'substructure': 'N/A'} |
|---|
Analyze 2-(8-aminoquinolin-5-yl)oxyacetamide with MolForge
Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.
Launch Full Analysis
Frequently Asked Questions
What is the IUPAC name of 2-(8-aminoquinolin-5-yl)oxyacetamide?
The IUPAC name of 2-(8-aminoquinolin-5-yl)oxyacetamide (CID 116524742) is 2-(8-aminoquinolin-5-yl)oxyacetamide.
What is the SMILES notation for 2-(8-aminoquinolin-5-yl)oxyacetamide?
The canonical SMILES for 2-(8-aminoquinolin-5-yl)oxyacetamide is NC(=O)COc1ccc(N)c2ncccc12.
What is the InChIKey of 2-(8-aminoquinolin-5-yl)oxyacetamide?
The InChIKey is RDGPNXLYFMTQMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11N3O2/c12-8-3-4-9(16-6-10(13)15)7-2-1-5-14-11(7)8/h1-5H,6,12H2,(H2,13,15).
What are the key properties of 2-(8-aminoquinolin-5-yl)oxyacetamide?
2-(8-aminoquinolin-5-yl)oxyacetamide has a molecular weight of 217.23 g/mol, XLogP of 0.68, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(8-aminoquinolin-5-yl)oxyacetamide is sourced from PubChem (CID 116524742), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).