About N-(1-benzothiophen-5-yl)-2-(5-chlorothiophen-2-yl)acetamide
N-(1-benzothiophen-5-yl)-2-(5-chlorothiophen-2-yl)acetamide (PubChem CID 41340494) has the molecular formula C14H10ClNOS2
and a molecular weight of 307.83 g/mol. Its IUPAC name is N-(1-benzothiophen-5-yl)-2-(5-chlorothiophen-2-yl)acetamide.
Molecular Properties
| Compound Name | N-(1-benzothiophen-5-yl)-2-(5-chlorothiophen-2-yl)acetamide |
| PubChem CID | 41340494 |
| Molecular Formula | C14H10ClNOS2 |
| Molecular Weight | 307.83 g/mol |
| Exact Mass | 306.99 |
| IUPAC Name | N-(1-benzothiophen-5-yl)-2-(5-chlorothiophen-2-yl)acetamide |
| SMILES | O=C(Cc1ccc(Cl)s1)Nc1ccc2sccc2c1 |
| InChI | InChI=1S/C14H10ClNOS2/c15-13-4-2-11(19-13)8-14(17)16-10-1-3-12-9(7-10)5-6-18-12/h1-7H,8H2,(H,16,17) |
| InChIKey | QGTZCEQVHSZSIB-UHFFFAOYSA-N |
| XLogP | 4.80 |
| TPSA | 29.10 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 19 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 307.83 |
| LogP ≤ 5 | 4.80 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of N-(1-benzothiophen-5-yl)-2-(5-chlorothiophen-2-yl)acetamide?
The IUPAC name of N-(1-benzothiophen-5-yl)-2-(5-chlorothiophen-2-yl)acetamide (CID 41340494) is N-(1-benzothiophen-5-yl)-2-(5-chlorothiophen-2-yl)acetamide.
What is the SMILES notation for N-(1-benzothiophen-5-yl)-2-(5-chlorothiophen-2-yl)acetamide?
The canonical SMILES for N-(1-benzothiophen-5-yl)-2-(5-chlorothiophen-2-yl)acetamide is O=C(Cc1ccc(Cl)s1)Nc1ccc2sccc2c1.
What is the InChIKey of N-(1-benzothiophen-5-yl)-2-(5-chlorothiophen-2-yl)acetamide?
The InChIKey is QGTZCEQVHSZSIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10ClNOS2/c15-13-4-2-11(19-13)8-14(17)16-10-1-3-12-9(7-10)5-6-18-12/h1-7H,8H2,(H,16,17).
What are the key properties of N-(1-benzothiophen-5-yl)-2-(5-chlorothiophen-2-yl)acetamide?
N-(1-benzothiophen-5-yl)-2-(5-chlorothiophen-2-yl)acetamide has a molecular weight of 307.83 g/mol, XLogP of 4.80, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-benzothiophen-5-yl)-2-(5-chlorothiophen-2-yl)acetamide is sourced from PubChem (CID 41340494), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).