About 6-(6-bromo-1H-indol-3-yl)pyridin-3-amine
6-(6-bromo-1H-indol-3-yl)pyridin-3-amine (PubChem CID 115110543) has the molecular formula C13H10BrN3
and a molecular weight of 288.15 g/mol. Its IUPAC name is 6-(6-bromo-1H-indol-3-yl)pyridin-3-amine.
Molecular Properties
| Compound Name | 6-(6-bromo-1H-indol-3-yl)pyridin-3-amine |
| PubChem CID | 115110543 |
| Molecular Formula | C13H10BrN3 |
| Molecular Weight | 288.15 g/mol |
| Exact Mass | 287.01 |
| IUPAC Name | 6-(6-bromo-1H-indol-3-yl)pyridin-3-amine |
| SMILES | Nc1ccc(-c2c[nH]c3cc(Br)ccc23)nc1 |
| InChI | InChI=1S/C13H10BrN3/c14-8-1-3-10-11(7-17-13(10)5-8)12-4-2-9(15)6-16-12/h1-7,17H,15H2 |
| InChIKey | RVLIXBKTPMBQGH-UHFFFAOYSA-N |
| XLogP | 3.57 |
| TPSA | 54.70 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Heavy Atoms | 17 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 288.15 |
| LogP ≤ 5 | 3.57 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of 6-(6-bromo-1H-indol-3-yl)pyridin-3-amine?
The IUPAC name of 6-(6-bromo-1H-indol-3-yl)pyridin-3-amine (CID 115110543) is 6-(6-bromo-1H-indol-3-yl)pyridin-3-amine.
What is the SMILES notation for 6-(6-bromo-1H-indol-3-yl)pyridin-3-amine?
The canonical SMILES for 6-(6-bromo-1H-indol-3-yl)pyridin-3-amine is Nc1ccc(-c2c[nH]c3cc(Br)ccc23)nc1.
What is the InChIKey of 6-(6-bromo-1H-indol-3-yl)pyridin-3-amine?
The InChIKey is RVLIXBKTPMBQGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10BrN3/c14-8-1-3-10-11(7-17-13(10)5-8)12-4-2-9(15)6-16-12/h1-7,17H,15H2.
What are the key properties of 6-(6-bromo-1H-indol-3-yl)pyridin-3-amine?
6-(6-bromo-1H-indol-3-yl)pyridin-3-amine has a molecular weight of 288.15 g/mol, XLogP of 3.57, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(6-bromo-1H-indol-3-yl)pyridin-3-amine is sourced from PubChem (CID 115110543), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).