2-(8-aminoquinolin-5-yl)oxyacetamide

C11H11N3O2 — CID 116524742

IUPAC2-(8-aminoquinolin-5-yl)oxyacetamide
SMILESNC(=O)COc1ccc(N)c2ncccc12
InChIInChI=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)
InChIKeyRDGPNXLYFMTQMP-UHFFFAOYSA-N
MW217.23 g/mol
LogP0.68
Rot. Bonds3

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 Name2-(8-aminoquinolin-5-yl)oxyacetamide
PubChem CID116524742
Molecular FormulaC11H11N3O2
Molecular Weight217.23 g/mol
Exact Mass217.09
IUPAC Name2-(8-aminoquinolin-5-yl)oxyacetamide
SMILESNC(=O)COc1ccc(N)c2ncccc12
InChIInChI=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)
InChIKeyRDGPNXLYFMTQMP-UHFFFAOYSA-N
XLogP0.68
TPSA91.23 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.23
LogP ≤ 50.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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).