About 1-phenyl-N-(2-thiophen-2-ylcyclopropyl)methanesulfonamide
1-phenyl-N-(2-thiophen-2-ylcyclopropyl)methanesulfonamide (PubChem CID 110711308) has the molecular formula C14H15NO2S2
and a molecular weight of 293.41 g/mol. Its IUPAC name is 1-phenyl-N-(2-thiophen-2-ylcyclopropyl)methanesulfonamide.
Molecular Properties
| Compound Name | 1-phenyl-N-(2-thiophen-2-ylcyclopropyl)methanesulfonamide |
| PubChem CID | 110711308 |
| Molecular Formula | C14H15NO2S2 |
| Molecular Weight | 293.41 g/mol |
| Exact Mass | 293.05 |
| IUPAC Name | 1-phenyl-N-(2-thiophen-2-ylcyclopropyl)methanesulfonamide |
| SMILES | O=S(=O)(Cc1ccccc1)NC1CC1c1cccs1 |
| InChI | InChI=1S/C14H15NO2S2/c16-19(17,10-11-5-2-1-3-6-11)15-13-9-12(13)14-7-4-8-18-14/h1-8,12-13,15H,9-10H2 |
| InChIKey | CRTBVYRIZXDMQD-UHFFFAOYSA-N |
| XLogP | 2.72 |
| TPSA | 46.17 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Heavy Atoms | 19 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 293.41 |
| LogP ≤ 5 | 2.72 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of 1-phenyl-N-(2-thiophen-2-ylcyclopropyl)methanesulfonamide?
The IUPAC name of 1-phenyl-N-(2-thiophen-2-ylcyclopropyl)methanesulfonamide (CID 110711308) is 1-phenyl-N-(2-thiophen-2-ylcyclopropyl)methanesulfonamide.
What is the SMILES notation for 1-phenyl-N-(2-thiophen-2-ylcyclopropyl)methanesulfonamide?
The canonical SMILES for 1-phenyl-N-(2-thiophen-2-ylcyclopropyl)methanesulfonamide is O=S(=O)(Cc1ccccc1)NC1CC1c1cccs1.
What is the InChIKey of 1-phenyl-N-(2-thiophen-2-ylcyclopropyl)methanesulfonamide?
The InChIKey is CRTBVYRIZXDMQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15NO2S2/c16-19(17,10-11-5-2-1-3-6-11)15-13-9-12(13)14-7-4-8-18-14/h1-8,12-13,15H,9-10H2.
What are the key properties of 1-phenyl-N-(2-thiophen-2-ylcyclopropyl)methanesulfonamide?
1-phenyl-N-(2-thiophen-2-ylcyclopropyl)methanesulfonamide has a molecular weight of 293.41 g/mol, XLogP of 2.72, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-phenyl-N-(2-thiophen-2-ylcyclopropyl)methanesulfonamide is sourced from PubChem (CID 110711308), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).