About 6-(3-chloro-5-fluorophenyl)pyridin-2-amine
6-(3-chloro-5-fluorophenyl)pyridin-2-amine (PubChem CID 115504598) has the molecular formula C11H8ClFN2
and a molecular weight of 222.65 g/mol. Its IUPAC name is 6-(3-chloro-5-fluorophenyl)pyridin-2-amine.
Molecular Properties
| Compound Name | 6-(3-chloro-5-fluorophenyl)pyridin-2-amine |
| PubChem CID | 115504598 |
| Molecular Formula | C11H8ClFN2 |
| Molecular Weight | 222.65 g/mol |
| Exact Mass | 222.04 |
| IUPAC Name | 6-(3-chloro-5-fluorophenyl)pyridin-2-amine |
| SMILES | Nc1cccc(-c2cc(F)cc(Cl)c2)n1 |
| InChI | InChI=1S/C11H8ClFN2/c12-8-4-7(5-9(13)6-8)10-2-1-3-11(14)15-10/h1-6H,(H2,14,15) |
| InChIKey | QBMJUXDUODUUIB-UHFFFAOYSA-N |
| XLogP | 3.12 |
| TPSA | 38.91 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Heavy Atoms | 15 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 222.65 |
| LogP ≤ 5 | 3.12 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of 6-(3-chloro-5-fluorophenyl)pyridin-2-amine?
The IUPAC name of 6-(3-chloro-5-fluorophenyl)pyridin-2-amine (CID 115504598) is 6-(3-chloro-5-fluorophenyl)pyridin-2-amine.
What is the SMILES notation for 6-(3-chloro-5-fluorophenyl)pyridin-2-amine?
The canonical SMILES for 6-(3-chloro-5-fluorophenyl)pyridin-2-amine is Nc1cccc(-c2cc(F)cc(Cl)c2)n1.
What is the InChIKey of 6-(3-chloro-5-fluorophenyl)pyridin-2-amine?
The InChIKey is QBMJUXDUODUUIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8ClFN2/c12-8-4-7(5-9(13)6-8)10-2-1-3-11(14)15-10/h1-6H,(H2,14,15).
What are the key properties of 6-(3-chloro-5-fluorophenyl)pyridin-2-amine?
6-(3-chloro-5-fluorophenyl)pyridin-2-amine has a molecular weight of 222.65 g/mol, XLogP of 3.12, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3-chloro-5-fluorophenyl)pyridin-2-amine is sourced from PubChem (CID 115504598), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).