About 6-isoquinolin-3-ylpyridin-3-amine
6-isoquinolin-3-ylpyridin-3-amine (PubChem CID 143968927) has the molecular formula C14H11N3
and a molecular weight of 221.26 g/mol. Its IUPAC name is 6-isoquinolin-3-ylpyridin-3-amine.
Molecular Properties
| Compound Name | 6-isoquinolin-3-ylpyridin-3-amine |
| PubChem CID | 143968927 |
| Molecular Formula | C14H11N3 |
| Molecular Weight | 221.26 g/mol |
| Exact Mass | 221.10 |
| IUPAC Name | 6-isoquinolin-3-ylpyridin-3-amine |
| SMILES | Nc1ccc(-c2cc3ccccc3cn2)nc1 |
| InChI | InChI=1S/C14H11N3/c15-12-5-6-13(17-9-12)14-7-10-3-1-2-4-11(10)8-16-14/h1-9H,15H2 |
| InChIKey | HRWOEJTZMYEENZ-UHFFFAOYSA-N |
| XLogP | 2.88 |
| TPSA | 51.80 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Heavy Atoms | 17 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 221.26 |
| LogP ≤ 5 | 2.88 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of 6-isoquinolin-3-ylpyridin-3-amine?
The IUPAC name of 6-isoquinolin-3-ylpyridin-3-amine (CID 143968927) is 6-isoquinolin-3-ylpyridin-3-amine.
What is the SMILES notation for 6-isoquinolin-3-ylpyridin-3-amine?
The canonical SMILES for 6-isoquinolin-3-ylpyridin-3-amine is Nc1ccc(-c2cc3ccccc3cn2)nc1.
What is the InChIKey of 6-isoquinolin-3-ylpyridin-3-amine?
The InChIKey is HRWOEJTZMYEENZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11N3/c15-12-5-6-13(17-9-12)14-7-10-3-1-2-4-11(10)8-16-14/h1-9H,15H2.
What are the key properties of 6-isoquinolin-3-ylpyridin-3-amine?
6-isoquinolin-3-ylpyridin-3-amine has a molecular weight of 221.26 g/mol, XLogP of 2.88, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-isoquinolin-3-ylpyridin-3-amine is sourced from PubChem (CID 143968927), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).