About 6-(3-bromophenoxy)-2-(2-methylpropoxy)pyridin-3-amine
6-(3-bromophenoxy)-2-(2-methylpropoxy)pyridin-3-amine (PubChem CID 43262128) has the molecular formula C15H17BrN2O2
and a molecular weight of 337.22 g/mol. Its IUPAC name is 6-(3-bromophenoxy)-2-(2-methylpropoxy)pyridin-3-amine.
Molecular Properties
| Compound Name | 6-(3-bromophenoxy)-2-(2-methylpropoxy)pyridin-3-amine |
| PubChem CID | 43262128 |
| Molecular Formula | C15H17BrN2O2 |
| Molecular Weight | 337.22 g/mol |
| Exact Mass | 336.05 |
| IUPAC Name | 6-(3-bromophenoxy)-2-(2-methylpropoxy)pyridin-3-amine |
| SMILES | CC(C)COc1nc(Oc2cccc(Br)c2)ccc1N |
| InChI | InChI=1S/C15H17BrN2O2/c1-10(2)9-19-15-13(17)6-7-14(18-15)20-12-5-3-4-11(16)8-12/h3-8,10H,9,17H2,1-2H3 |
| InChIKey | QMUSBVQVLNWWOG-UHFFFAOYSA-N |
| XLogP | 4.25 |
| TPSA | 57.37 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Heavy Atoms | 20 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 337.22 |
| LogP ≤ 5 | 4.25 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 4 |
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Frequently Asked Questions
What is the IUPAC name of 6-(3-bromophenoxy)-2-(2-methylpropoxy)pyridin-3-amine?
The IUPAC name of 6-(3-bromophenoxy)-2-(2-methylpropoxy)pyridin-3-amine (CID 43262128) is 6-(3-bromophenoxy)-2-(2-methylpropoxy)pyridin-3-amine.
What is the SMILES notation for 6-(3-bromophenoxy)-2-(2-methylpropoxy)pyridin-3-amine?
The canonical SMILES for 6-(3-bromophenoxy)-2-(2-methylpropoxy)pyridin-3-amine is CC(C)COc1nc(Oc2cccc(Br)c2)ccc1N.
What is the InChIKey of 6-(3-bromophenoxy)-2-(2-methylpropoxy)pyridin-3-amine?
The InChIKey is QMUSBVQVLNWWOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17BrN2O2/c1-10(2)9-19-15-13(17)6-7-14(18-15)20-12-5-3-4-11(16)8-12/h3-8,10H,9,17H2,1-2H3.
What are the key properties of 6-(3-bromophenoxy)-2-(2-methylpropoxy)pyridin-3-amine?
6-(3-bromophenoxy)-2-(2-methylpropoxy)pyridin-3-amine has a molecular weight of 337.22 g/mol, XLogP of 4.25, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3-bromophenoxy)-2-(2-methylpropoxy)pyridin-3-amine is sourced from PubChem (CID 43262128), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).