About 5-(4-chlorophenyl)-6-methylpyridin-3-amine
5-(4-chlorophenyl)-6-methylpyridin-3-amine (PubChem CID 165369043) has the molecular formula C12H11ClN2
and a molecular weight of 218.69 g/mol. Its IUPAC name is 5-(4-chlorophenyl)-6-methylpyridin-3-amine.
Molecular Properties
| Compound Name | 5-(4-chlorophenyl)-6-methylpyridin-3-amine |
| PubChem CID | 165369043 |
| Molecular Formula | C12H11ClN2 |
| Molecular Weight | 218.69 g/mol |
| Exact Mass | 218.06 |
| IUPAC Name | 5-(4-chlorophenyl)-6-methylpyridin-3-amine |
| SMILES | Cc1ncc(N)cc1-c1ccc(Cl)cc1 |
| InChI | InChI=1S/C12H11ClN2/c1-8-12(6-11(14)7-15-8)9-2-4-10(13)5-3-9/h2-7H,14H2,1H3 |
| InChIKey | SWIBWVACIBGLSU-UHFFFAOYSA-N |
| XLogP | 3.29 |
| 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 | 218.69 |
| LogP ≤ 5 | 3.29 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of 5-(4-chlorophenyl)-6-methylpyridin-3-amine?
The IUPAC name of 5-(4-chlorophenyl)-6-methylpyridin-3-amine (CID 165369043) is 5-(4-chlorophenyl)-6-methylpyridin-3-amine.
What is the SMILES notation for 5-(4-chlorophenyl)-6-methylpyridin-3-amine?
The canonical SMILES for 5-(4-chlorophenyl)-6-methylpyridin-3-amine is Cc1ncc(N)cc1-c1ccc(Cl)cc1.
What is the InChIKey of 5-(4-chlorophenyl)-6-methylpyridin-3-amine?
The InChIKey is SWIBWVACIBGLSU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11ClN2/c1-8-12(6-11(14)7-15-8)9-2-4-10(13)5-3-9/h2-7H,14H2,1H3.
What are the key properties of 5-(4-chlorophenyl)-6-methylpyridin-3-amine?
5-(4-chlorophenyl)-6-methylpyridin-3-amine has a molecular weight of 218.69 g/mol, XLogP of 3.29, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-chlorophenyl)-6-methylpyridin-3-amine is sourced from PubChem (CID 165369043), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).