About 1-(2-methoxyphenyl)-5-thiophen-2-ylimidazole
1-(2-methoxyphenyl)-5-thiophen-2-ylimidazole (PubChem CID 159345330) has the molecular formula C14H12N2OS
and a molecular weight of 256.33 g/mol. Its IUPAC name is 1-(2-methoxyphenyl)-5-thiophen-2-ylimidazole.
Molecular Properties
| Compound Name | 1-(2-methoxyphenyl)-5-thiophen-2-ylimidazole |
| PubChem CID | 159345330 |
| Molecular Formula | C14H12N2OS |
| Molecular Weight | 256.33 g/mol |
| Exact Mass | 256.07 |
| IUPAC Name | 1-(2-methoxyphenyl)-5-thiophen-2-ylimidazole |
| SMILES | COc1ccccc1-n1cncc1-c1cccs1 |
| InChI | InChI=1S/C14H12N2OS/c1-17-13-6-3-2-5-11(13)16-10-15-9-12(16)14-7-4-8-18-14/h2-10H,1H3 |
| InChIKey | IQLMJNFYCDSZPX-UHFFFAOYSA-N |
| XLogP | 3.61 |
| TPSA | 27.05 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 18 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 256.33 |
| LogP ≤ 5 | 3.61 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 4 |
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Frequently Asked Questions
What is the IUPAC name of 1-(2-methoxyphenyl)-5-thiophen-2-ylimidazole?
The IUPAC name of 1-(2-methoxyphenyl)-5-thiophen-2-ylimidazole (CID 159345330) is 1-(2-methoxyphenyl)-5-thiophen-2-ylimidazole.
What is the SMILES notation for 1-(2-methoxyphenyl)-5-thiophen-2-ylimidazole?
The canonical SMILES for 1-(2-methoxyphenyl)-5-thiophen-2-ylimidazole is COc1ccccc1-n1cncc1-c1cccs1.
What is the InChIKey of 1-(2-methoxyphenyl)-5-thiophen-2-ylimidazole?
The InChIKey is IQLMJNFYCDSZPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12N2OS/c1-17-13-6-3-2-5-11(13)16-10-15-9-12(16)14-7-4-8-18-14/h2-10H,1H3.
What are the key properties of 1-(2-methoxyphenyl)-5-thiophen-2-ylimidazole?
1-(2-methoxyphenyl)-5-thiophen-2-ylimidazole has a molecular weight of 256.33 g/mol, XLogP of 3.61, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methoxyphenyl)-5-thiophen-2-ylimidazole is sourced from PubChem (CID 159345330), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).