About 3,5-diphenyl-1H-imidazol-2-one
3,5-diphenyl-1H-imidazol-2-one (PubChem CID 24963953) has the molecular formula C15H12N2O
and a molecular weight of 236.27 g/mol. Its IUPAC name is 3,5-diphenyl-1H-imidazol-2-one.
Molecular Properties
| Compound Name | 3,5-diphenyl-1H-imidazol-2-one |
| PubChem CID | 24963953 |
| Molecular Formula | C15H12N2O |
| Molecular Weight | 236.27 g/mol |
| Exact Mass | 236.09 |
| IUPAC Name | 3,5-diphenyl-1H-imidazol-2-one |
| SMILES | O=c1[nH]c(-c2ccccc2)cn1-c1ccccc1 |
| InChI | InChI=1S/C15H12N2O/c18-15-16-14(12-7-3-1-4-8-12)11-17(15)13-9-5-2-6-10-13/h1-11H,(H,16,18) |
| InChIKey | ALGBWUXZUSQIQY-UHFFFAOYSA-N |
| XLogP | 2.83 |
| TPSA | 37.79 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 18 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 236.27 |
| LogP ≤ 5 | 2.83 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of 3,5-diphenyl-1H-imidazol-2-one?
The IUPAC name of 3,5-diphenyl-1H-imidazol-2-one (CID 24963953) is 3,5-diphenyl-1H-imidazol-2-one.
What is the SMILES notation for 3,5-diphenyl-1H-imidazol-2-one?
The canonical SMILES for 3,5-diphenyl-1H-imidazol-2-one is O=c1[nH]c(-c2ccccc2)cn1-c1ccccc1.
What is the InChIKey of 3,5-diphenyl-1H-imidazol-2-one?
The InChIKey is ALGBWUXZUSQIQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12N2O/c18-15-16-14(12-7-3-1-4-8-12)11-17(15)13-9-5-2-6-10-13/h1-11H,(H,16,18).
What are the key properties of 3,5-diphenyl-1H-imidazol-2-one?
3,5-diphenyl-1H-imidazol-2-one has a molecular weight of 236.27 g/mol, XLogP of 2.83, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-diphenyl-1H-imidazol-2-one is sourced from PubChem (CID 24963953), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).