About N-oxo-2-thiophen-2-ylbenzamide
N-oxo-2-thiophen-2-ylbenzamide (PubChem CID 134287051) has the molecular formula C11H7NO2S
and a molecular weight of 217.25 g/mol. Its IUPAC name is N-oxo-2-thiophen-2-ylbenzamide.
Molecular Properties
| Compound Name | N-oxo-2-thiophen-2-ylbenzamide |
| PubChem CID | 134287051 |
| Molecular Formula | C11H7NO2S |
| Molecular Weight | 217.25 g/mol |
| Exact Mass | 217.02 |
| IUPAC Name | N-oxo-2-thiophen-2-ylbenzamide |
| SMILES | O=NC(=O)c1ccccc1-c1cccs1 |
| InChI | InChI=1S/C11H7NO2S/c13-11(12-14)9-5-2-1-4-8(9)10-6-3-7-15-10/h1-7H |
| InChIKey | UZBZGLUCFJMMQC-UHFFFAOYSA-N |
| XLogP | 3.32 |
| TPSA | 46.50 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 15 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 217.25 |
| LogP ≤ 5 | 3.32 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of N-oxo-2-thiophen-2-ylbenzamide?
The IUPAC name of N-oxo-2-thiophen-2-ylbenzamide (CID 134287051) is N-oxo-2-thiophen-2-ylbenzamide.
What is the SMILES notation for N-oxo-2-thiophen-2-ylbenzamide?
The canonical SMILES for N-oxo-2-thiophen-2-ylbenzamide is O=NC(=O)c1ccccc1-c1cccs1.
What is the InChIKey of N-oxo-2-thiophen-2-ylbenzamide?
The InChIKey is UZBZGLUCFJMMQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H7NO2S/c13-11(12-14)9-5-2-1-4-8(9)10-6-3-7-15-10/h1-7H.
What are the key properties of N-oxo-2-thiophen-2-ylbenzamide?
N-oxo-2-thiophen-2-ylbenzamide has a molecular weight of 217.25 g/mol, XLogP of 3.32, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-oxo-2-thiophen-2-ylbenzamide is sourced from PubChem (CID 134287051), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).