About 2-(2-chlorophenyl)sulfanyl-N-(2-phenoxy-3-pyridinyl)acetamide
2-(2-chlorophenyl)sulfanyl-N-(2-phenoxy-3-pyridinyl)acetamide (PubChem CID 43072075) has the molecular formula C19H15ClN2O2S
and a molecular weight of 370.86 g/mol. Its IUPAC name is 2-(2-chlorophenyl)sulfanyl-N-(2-phenoxy-3-pyridinyl)acetamide.
Molecular Properties
| Compound Name | 2-(2-chlorophenyl)sulfanyl-N-(2-phenoxy-3-pyridinyl)acetamide |
| PubChem CID | 43072075 |
| Molecular Formula | C19H15ClN2O2S |
| Molecular Weight | 370.86 g/mol |
| Exact Mass | 370.05 |
| IUPAC Name | 2-(2-chlorophenyl)sulfanyl-N-(2-phenoxy-3-pyridinyl)acetamide |
| SMILES | O=C(CSc1ccccc1Cl)Nc1cccnc1Oc1ccccc1 |
| InChI | InChI=1S/C19H15ClN2O2S/c20-15-9-4-5-11-17(15)25-13-18(23)22-16-10-6-12-21-19(16)24-14-7-2-1-3-8-14/h1-12H,13H2,(H,22,23) |
| InChIKey | CWRPKCODTRSTLR-UHFFFAOYSA-N |
| XLogP | 5.26 |
| TPSA | 51.22 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Heavy Atoms | 25 |
| Complexity | — |
Lipinski Rule of Five
1 violation
| Rule | Value |
| MW ≤ 500 | 370.86 |
| LogP ≤ 5 | 5.26 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 4 |
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Frequently Asked Questions
What is the IUPAC name of 2-(2-chlorophenyl)sulfanyl-N-(2-phenoxy-3-pyridinyl)acetamide?
The IUPAC name of 2-(2-chlorophenyl)sulfanyl-N-(2-phenoxy-3-pyridinyl)acetamide (CID 43072075) is 2-(2-chlorophenyl)sulfanyl-N-(2-phenoxy-3-pyridinyl)acetamide.
What is the SMILES notation for 2-(2-chlorophenyl)sulfanyl-N-(2-phenoxy-3-pyridinyl)acetamide?
The canonical SMILES for 2-(2-chlorophenyl)sulfanyl-N-(2-phenoxy-3-pyridinyl)acetamide is O=C(CSc1ccccc1Cl)Nc1cccnc1Oc1ccccc1.
What is the InChIKey of 2-(2-chlorophenyl)sulfanyl-N-(2-phenoxy-3-pyridinyl)acetamide?
The InChIKey is CWRPKCODTRSTLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15ClN2O2S/c20-15-9-4-5-11-17(15)25-13-18(23)22-16-10-6-12-21-19(16)24-14-7-2-1-3-8-14/h1-12H,13H2,(H,22,23).
What are the key properties of 2-(2-chlorophenyl)sulfanyl-N-(2-phenoxy-3-pyridinyl)acetamide?
2-(2-chlorophenyl)sulfanyl-N-(2-phenoxy-3-pyridinyl)acetamide has a molecular weight of 370.86 g/mol, XLogP of 5.26, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chlorophenyl)sulfanyl-N-(2-phenoxy-3-pyridinyl)acetamide is sourced from PubChem (CID 43072075), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).