About 1-(8-ethoxy-2-methylquinolin-4-yl)ethanamine
1-(8-ethoxy-2-methylquinolin-4-yl)ethanamine (PubChem CID 82575817) has the molecular formula C14H18N2O
and a molecular weight of 230.31 g/mol. Its IUPAC name is 1-(8-ethoxy-2-methylquinolin-4-yl)ethanamine.
Molecular Properties
| Compound Name | 1-(8-ethoxy-2-methylquinolin-4-yl)ethanamine |
| PubChem CID | 82575817 |
| Molecular Formula | C14H18N2O |
| Molecular Weight | 230.31 g/mol |
| Exact Mass | 230.14 |
| IUPAC Name | 1-(8-ethoxy-2-methylquinolin-4-yl)ethanamine |
| SMILES | CCOc1cccc2c(C(C)N)cc(C)nc12 |
| InChI | InChI=1S/C14H18N2O/c1-4-17-13-7-5-6-11-12(10(3)15)8-9(2)16-14(11)13/h5-8,10H,4,15H2,1-3H3 |
| InChIKey | CYLUEOIGDULZSZ-UHFFFAOYSA-N |
| XLogP | 2.96 |
| TPSA | 48.14 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 17 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 230.31 |
| LogP ≤ 5 | 2.96 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 3 |
Analyze 1-(8-ethoxy-2-methylquinolin-4-yl)ethanamine 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 1-(8-ethoxy-2-methylquinolin-4-yl)ethanamine?
The IUPAC name of 1-(8-ethoxy-2-methylquinolin-4-yl)ethanamine (CID 82575817) is 1-(8-ethoxy-2-methylquinolin-4-yl)ethanamine.
What is the SMILES notation for 1-(8-ethoxy-2-methylquinolin-4-yl)ethanamine?
The canonical SMILES for 1-(8-ethoxy-2-methylquinolin-4-yl)ethanamine is CCOc1cccc2c(C(C)N)cc(C)nc12.
What is the InChIKey of 1-(8-ethoxy-2-methylquinolin-4-yl)ethanamine?
The InChIKey is CYLUEOIGDULZSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O/c1-4-17-13-7-5-6-11-12(10(3)15)8-9(2)16-14(11)13/h5-8,10H,4,15H2,1-3H3.
What are the key properties of 1-(8-ethoxy-2-methylquinolin-4-yl)ethanamine?
1-(8-ethoxy-2-methylquinolin-4-yl)ethanamine has a molecular weight of 230.31 g/mol, XLogP of 2.96, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(8-ethoxy-2-methylquinolin-4-yl)ethanamine is sourced from PubChem (CID 82575817), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).