About 5-bromo-3-(difluoromethyl)-6-methylpyridin-2-amine
5-bromo-3-(difluoromethyl)-6-methylpyridin-2-amine (PubChem CID 130101784) has the molecular formula C7H7BrF2N2
and a molecular weight of 237.05 g/mol. Its IUPAC name is 5-bromo-3-(difluoromethyl)-6-methylpyridin-2-amine.
Molecular Properties
| Compound Name | 5-bromo-3-(difluoromethyl)-6-methylpyridin-2-amine |
| PubChem CID | 130101784 |
| Molecular Formula | C7H7BrF2N2 |
| Molecular Weight | 237.05 g/mol |
| Exact Mass | 235.98 |
| IUPAC Name | 5-bromo-3-(difluoromethyl)-6-methylpyridin-2-amine |
| SMILES | Cc1nc(N)c(C(F)F)cc1Br |
| InChI | InChI=1S/C7H7BrF2N2/c1-3-5(8)2-4(6(9)10)7(11)12-3/h2,6H,1H3,(H2,11,12) |
| InChIKey | LLAWIURTVUGNDR-UHFFFAOYSA-N |
| XLogP | 2.67 |
| TPSA | 38.91 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Heavy Atoms | 12 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 237.05 |
| LogP ≤ 5 | 2.67 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of 5-bromo-3-(difluoromethyl)-6-methylpyridin-2-amine?
The IUPAC name of 5-bromo-3-(difluoromethyl)-6-methylpyridin-2-amine (CID 130101784) is 5-bromo-3-(difluoromethyl)-6-methylpyridin-2-amine.
What is the SMILES notation for 5-bromo-3-(difluoromethyl)-6-methylpyridin-2-amine?
The canonical SMILES for 5-bromo-3-(difluoromethyl)-6-methylpyridin-2-amine is Cc1nc(N)c(C(F)F)cc1Br.
What is the InChIKey of 5-bromo-3-(difluoromethyl)-6-methylpyridin-2-amine?
The InChIKey is LLAWIURTVUGNDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7BrF2N2/c1-3-5(8)2-4(6(9)10)7(11)12-3/h2,6H,1H3,(H2,11,12).
What are the key properties of 5-bromo-3-(difluoromethyl)-6-methylpyridin-2-amine?
5-bromo-3-(difluoromethyl)-6-methylpyridin-2-amine has a molecular weight of 237.05 g/mol, XLogP of 2.67, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-3-(difluoromethyl)-6-methylpyridin-2-amine is sourced from PubChem (CID 130101784), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).