About 6-methoxy-N-methyl-4-[4-(methylamino)phenoxy]quinolin-7-amine
6-methoxy-N-methyl-4-[4-(methylamino)phenoxy]quinolin-7-amine (PubChem CID 163694913) has the molecular formula C18H19N3O2
and a molecular weight of 309.37 g/mol. Its IUPAC name is 6-methoxy-N-methyl-4-[4-(methylamino)phenoxy]quinolin-7-amine.
Molecular Properties
| Compound Name | 6-methoxy-N-methyl-4-[4-(methylamino)phenoxy]quinolin-7-amine |
| PubChem CID | 163694913 |
| Molecular Formula | C18H19N3O2 |
| Molecular Weight | 309.37 g/mol |
| Exact Mass | 309.15 |
| IUPAC Name | 6-methoxy-N-methyl-4-[4-(methylamino)phenoxy]quinolin-7-amine |
| SMILES | CNc1ccc(Oc2ccnc3cc(NC)c(OC)cc23)cc1 |
| InChI | InChI=1S/C18H19N3O2/c1-19-12-4-6-13(7-5-12)23-17-8-9-21-15-11-16(20-2)18(22-3)10-14(15)17/h4-11,19-20H,1-3H3 |
| InChIKey | JWDMMNJPAASSTJ-UHFFFAOYSA-N |
| XLogP | 4.12 |
| TPSA | 55.41 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Heavy Atoms | 23 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 309.37 |
| LogP ≤ 5 | 4.12 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 5 |
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Frequently Asked Questions
What is the IUPAC name of 6-methoxy-N-methyl-4-[4-(methylamino)phenoxy]quinolin-7-amine?
The IUPAC name of 6-methoxy-N-methyl-4-[4-(methylamino)phenoxy]quinolin-7-amine (CID 163694913) is 6-methoxy-N-methyl-4-[4-(methylamino)phenoxy]quinolin-7-amine.
What is the SMILES notation for 6-methoxy-N-methyl-4-[4-(methylamino)phenoxy]quinolin-7-amine?
The canonical SMILES for 6-methoxy-N-methyl-4-[4-(methylamino)phenoxy]quinolin-7-amine is CNc1ccc(Oc2ccnc3cc(NC)c(OC)cc23)cc1.
What is the InChIKey of 6-methoxy-N-methyl-4-[4-(methylamino)phenoxy]quinolin-7-amine?
The InChIKey is JWDMMNJPAASSTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N3O2/c1-19-12-4-6-13(7-5-12)23-17-8-9-21-15-11-16(20-2)18(22-3)10-14(15)17/h4-11,19-20H,1-3H3.
What are the key properties of 6-methoxy-N-methyl-4-[4-(methylamino)phenoxy]quinolin-7-amine?
6-methoxy-N-methyl-4-[4-(methylamino)phenoxy]quinolin-7-amine has a molecular weight of 309.37 g/mol, XLogP of 4.12, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-N-methyl-4-[4-(methylamino)phenoxy]quinolin-7-amine is sourced from PubChem (CID 163694913), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).