About 1-[2-(3-methoxyphenyl)phenyl]imidazole
1-[2-(3-methoxyphenyl)phenyl]imidazole (PubChem CID 57072963) has the molecular formula C16H14N2O
and a molecular weight of 250.30 g/mol. Its IUPAC name is 1-[2-(3-methoxyphenyl)phenyl]imidazole.
Molecular Properties
| Compound Name | 1-[2-(3-methoxyphenyl)phenyl]imidazole |
| PubChem CID | 57072963 |
| Molecular Formula | C16H14N2O |
| Molecular Weight | 250.30 g/mol |
| Exact Mass | 250.11 |
| IUPAC Name | 1-[2-(3-methoxyphenyl)phenyl]imidazole |
| SMILES | COc1cccc(-c2ccccc2-n2ccnc2)c1 |
| InChI | InChI=1S/C16H14N2O/c1-19-14-6-4-5-13(11-14)15-7-2-3-8-16(15)18-10-9-17-12-18/h2-12H,1H3 |
| InChIKey | STSDEJZOWYKRLL-UHFFFAOYSA-N |
| XLogP | 3.55 |
| TPSA | 27.05 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 19 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 250.30 |
| LogP ≤ 5 | 3.55 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of 1-[2-(3-methoxyphenyl)phenyl]imidazole?
The IUPAC name of 1-[2-(3-methoxyphenyl)phenyl]imidazole (CID 57072963) is 1-[2-(3-methoxyphenyl)phenyl]imidazole.
What is the SMILES notation for 1-[2-(3-methoxyphenyl)phenyl]imidazole?
The canonical SMILES for 1-[2-(3-methoxyphenyl)phenyl]imidazole is COc1cccc(-c2ccccc2-n2ccnc2)c1.
What is the InChIKey of 1-[2-(3-methoxyphenyl)phenyl]imidazole?
The InChIKey is STSDEJZOWYKRLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N2O/c1-19-14-6-4-5-13(11-14)15-7-2-3-8-16(15)18-10-9-17-12-18/h2-12H,1H3.
What are the key properties of 1-[2-(3-methoxyphenyl)phenyl]imidazole?
1-[2-(3-methoxyphenyl)phenyl]imidazole has a molecular weight of 250.30 g/mol, XLogP of 3.55, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(3-methoxyphenyl)phenyl]imidazole is sourced from PubChem (CID 57072963), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).