About 4-(2-methoxyphenoxy)-2-methylbenzenesulfonamide
4-(2-methoxyphenoxy)-2-methylbenzenesulfonamide (PubChem CID 43436547) has the molecular formula C14H15NO4S
and a molecular weight of 293.34 g/mol. Its IUPAC name is 4-(2-methoxyphenoxy)-2-methylbenzenesulfonamide.
Molecular Properties
| Compound Name | 4-(2-methoxyphenoxy)-2-methylbenzenesulfonamide |
| PubChem CID | 43436547 |
| Molecular Formula | C14H15NO4S |
| Molecular Weight | 293.34 g/mol |
| Exact Mass | 293.07 |
| IUPAC Name | 4-(2-methoxyphenoxy)-2-methylbenzenesulfonamide |
| SMILES | COc1ccccc1Oc1ccc(S(N)(=O)=O)c(C)c1 |
| InChI | InChI=1S/C14H15NO4S/c1-10-9-11(7-8-14(10)20(15,16)17)19-13-6-4-3-5-12(13)18-2/h3-9H,1-2H3,(H2,15,16,17) |
| InChIKey | KOMJGWXKQRWKSW-UHFFFAOYSA-N |
| XLogP | 2.44 |
| TPSA | 78.62 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 20 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 293.34 |
| LogP ≤ 5 | 2.44 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 4 |
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Frequently Asked Questions
What is the IUPAC name of 4-(2-methoxyphenoxy)-2-methylbenzenesulfonamide?
The IUPAC name of 4-(2-methoxyphenoxy)-2-methylbenzenesulfonamide (CID 43436547) is 4-(2-methoxyphenoxy)-2-methylbenzenesulfonamide.
What is the SMILES notation for 4-(2-methoxyphenoxy)-2-methylbenzenesulfonamide?
The canonical SMILES for 4-(2-methoxyphenoxy)-2-methylbenzenesulfonamide is COc1ccccc1Oc1ccc(S(N)(=O)=O)c(C)c1.
What is the InChIKey of 4-(2-methoxyphenoxy)-2-methylbenzenesulfonamide?
The InChIKey is KOMJGWXKQRWKSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15NO4S/c1-10-9-11(7-8-14(10)20(15,16)17)19-13-6-4-3-5-12(13)18-2/h3-9H,1-2H3,(H2,15,16,17).
What are the key properties of 4-(2-methoxyphenoxy)-2-methylbenzenesulfonamide?
4-(2-methoxyphenoxy)-2-methylbenzenesulfonamide has a molecular weight of 293.34 g/mol, XLogP of 2.44, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-methoxyphenoxy)-2-methylbenzenesulfonamide is sourced from PubChem (CID 43436547), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).