About N-(2-ethoxyphenyl)-8-methoxy-2-methylquinolin-4-amine
N-(2-ethoxyphenyl)-8-methoxy-2-methylquinolin-4-amine (PubChem CID 798265) has the molecular formula C19H20N2O2
and a molecular weight of 308.38 g/mol. Its IUPAC name is N-(2-ethoxyphenyl)-8-methoxy-2-methylquinolin-4-amine.
Molecular Properties
| Compound Name | N-(2-ethoxyphenyl)-8-methoxy-2-methylquinolin-4-amine |
| PubChem CID | 798265 |
| Molecular Formula | C19H20N2O2 |
| Molecular Weight | 308.38 g/mol |
| Exact Mass | 308.15 |
| IUPAC Name | N-(2-ethoxyphenyl)-8-methoxy-2-methylquinolin-4-amine |
| SMILES | CCOc1ccccc1Nc1cc(C)nc2c(OC)cccc12 |
| InChI | InChI=1S/C19H20N2O2/c1-4-23-17-10-6-5-9-15(17)21-16-12-13(2)20-19-14(16)8-7-11-18(19)22-3/h5-12H,4H2,1-3H3,(H,20,21) |
| InChIKey | VGQMDQFTJHVEJJ-UHFFFAOYSA-N |
| XLogP | 4.69 |
| TPSA | 43.38 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Heavy Atoms | 23 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 308.38 |
| LogP ≤ 5 | 4.69 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 4 |
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Frequently Asked Questions
What is the IUPAC name of N-(2-ethoxyphenyl)-8-methoxy-2-methylquinolin-4-amine?
The IUPAC name of N-(2-ethoxyphenyl)-8-methoxy-2-methylquinolin-4-amine (CID 798265) is N-(2-ethoxyphenyl)-8-methoxy-2-methylquinolin-4-amine.
What is the SMILES notation for N-(2-ethoxyphenyl)-8-methoxy-2-methylquinolin-4-amine?
The canonical SMILES for N-(2-ethoxyphenyl)-8-methoxy-2-methylquinolin-4-amine is CCOc1ccccc1Nc1cc(C)nc2c(OC)cccc12.
What is the InChIKey of N-(2-ethoxyphenyl)-8-methoxy-2-methylquinolin-4-amine?
The InChIKey is VGQMDQFTJHVEJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2O2/c1-4-23-17-10-6-5-9-15(17)21-16-12-13(2)20-19-14(16)8-7-11-18(19)22-3/h5-12H,4H2,1-3H3,(H,20,21).
What are the key properties of N-(2-ethoxyphenyl)-8-methoxy-2-methylquinolin-4-amine?
N-(2-ethoxyphenyl)-8-methoxy-2-methylquinolin-4-amine has a molecular weight of 308.38 g/mol, XLogP of 4.69, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethoxyphenyl)-8-methoxy-2-methylquinolin-4-amine is sourced from PubChem (CID 798265), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).