About 3-(2-methoxyquinolin-3-yl)pyridin-4-amine
3-(2-methoxyquinolin-3-yl)pyridin-4-amine (PubChem CID 50957760) has the molecular formula C15H13N3O
and a molecular weight of 251.29 g/mol. Its IUPAC name is 3-(2-methoxyquinolin-3-yl)pyridin-4-amine.
Molecular Properties
| Compound Name | 3-(2-methoxyquinolin-3-yl)pyridin-4-amine |
| PubChem CID | 50957760 |
| Molecular Formula | C15H13N3O |
| Molecular Weight | 251.29 g/mol |
| Exact Mass | 251.11 |
| IUPAC Name | 3-(2-methoxyquinolin-3-yl)pyridin-4-amine |
| SMILES | COc1nc2ccccc2cc1-c1cnccc1N |
| InChI | InChI=1S/C15H13N3O/c1-19-15-11(12-9-17-7-6-13(12)16)8-10-4-2-3-5-14(10)18-15/h2-9H,1H3,(H2,16,17) |
| InChIKey | RIVLCOBCZGAHMI-UHFFFAOYSA-N |
| XLogP | 2.89 |
| TPSA | 61.03 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 19 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 251.29 |
| LogP ≤ 5 | 2.89 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 4 |
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Frequently Asked Questions
What is the IUPAC name of 3-(2-methoxyquinolin-3-yl)pyridin-4-amine?
The IUPAC name of 3-(2-methoxyquinolin-3-yl)pyridin-4-amine (CID 50957760) is 3-(2-methoxyquinolin-3-yl)pyridin-4-amine.
What is the SMILES notation for 3-(2-methoxyquinolin-3-yl)pyridin-4-amine?
The canonical SMILES for 3-(2-methoxyquinolin-3-yl)pyridin-4-amine is COc1nc2ccccc2cc1-c1cnccc1N.
What is the InChIKey of 3-(2-methoxyquinolin-3-yl)pyridin-4-amine?
The InChIKey is RIVLCOBCZGAHMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13N3O/c1-19-15-11(12-9-17-7-6-13(12)16)8-10-4-2-3-5-14(10)18-15/h2-9H,1H3,(H2,16,17).
What are the key properties of 3-(2-methoxyquinolin-3-yl)pyridin-4-amine?
3-(2-methoxyquinolin-3-yl)pyridin-4-amine has a molecular weight of 251.29 g/mol, XLogP of 2.89, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-methoxyquinolin-3-yl)pyridin-4-amine is sourced from PubChem (CID 50957760), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).