About 5-bromo-N-(2-chloro-6-methylphenyl)pyridin-2-amine
5-bromo-N-(2-chloro-6-methylphenyl)pyridin-2-amine (PubChem CID 66255644) has the molecular formula C12H10BrClN2
and a molecular weight of 297.58 g/mol. Its IUPAC name is 5-bromo-N-(2-chloro-6-methylphenyl)pyridin-2-amine.
Molecular Properties
| Compound Name | 5-bromo-N-(2-chloro-6-methylphenyl)pyridin-2-amine |
| PubChem CID | 66255644 |
| Molecular Formula | C12H10BrClN2 |
| Molecular Weight | 297.58 g/mol |
| Exact Mass | 295.97 |
| IUPAC Name | 5-bromo-N-(2-chloro-6-methylphenyl)pyridin-2-amine |
| SMILES | Cc1cccc(Cl)c1Nc1ccc(Br)cn1 |
| InChI | InChI=1S/C12H10BrClN2/c1-8-3-2-4-10(14)12(8)16-11-6-5-9(13)7-15-11/h2-7H,1H3,(H,15,16) |
| InChIKey | RFWMVMOIGZGYBH-UHFFFAOYSA-N |
| XLogP | 4.55 |
| TPSA | 24.92 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 16 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 297.58 |
| LogP ≤ 5 | 4.55 |
| 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-N-(2-chloro-6-methylphenyl)pyridin-2-amine?
The IUPAC name of 5-bromo-N-(2-chloro-6-methylphenyl)pyridin-2-amine (CID 66255644) is 5-bromo-N-(2-chloro-6-methylphenyl)pyridin-2-amine.
What is the SMILES notation for 5-bromo-N-(2-chloro-6-methylphenyl)pyridin-2-amine?
The canonical SMILES for 5-bromo-N-(2-chloro-6-methylphenyl)pyridin-2-amine is Cc1cccc(Cl)c1Nc1ccc(Br)cn1.
What is the InChIKey of 5-bromo-N-(2-chloro-6-methylphenyl)pyridin-2-amine?
The InChIKey is RFWMVMOIGZGYBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10BrClN2/c1-8-3-2-4-10(14)12(8)16-11-6-5-9(13)7-15-11/h2-7H,1H3,(H,15,16).
What are the key properties of 5-bromo-N-(2-chloro-6-methylphenyl)pyridin-2-amine?
5-bromo-N-(2-chloro-6-methylphenyl)pyridin-2-amine has a molecular weight of 297.58 g/mol, XLogP of 4.55, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-N-(2-chloro-6-methylphenyl)pyridin-2-amine is sourced from PubChem (CID 66255644), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).