About N-(4-imidazol-1-ylphenyl)acetamide
N-(4-imidazol-1-ylphenyl)acetamide (PubChem CID 16761727) has the molecular formula C11H11N3O
and a molecular weight of 201.23 g/mol. Its IUPAC name is N-(4-imidazol-1-ylphenyl)acetamide.
Molecular Properties
| Compound Name | N-(4-imidazol-1-ylphenyl)acetamide |
| PubChem CID | 16761727 |
| Molecular Formula | C11H11N3O |
| Molecular Weight | 201.23 g/mol |
| Exact Mass | 201.09 |
| IUPAC Name | N-(4-imidazol-1-ylphenyl)acetamide |
| SMILES | CC(=O)Nc1ccc(-n2ccnc2)cc1 |
| InChI | InChI=1S/C11H11N3O/c1-9(15)13-10-2-4-11(5-3-10)14-7-6-12-8-14/h2-8H,1H3,(H,13,15) |
| InChIKey | SLCNHWPKGYFGIJ-UHFFFAOYSA-N |
| XLogP | 1.83 |
| TPSA | 46.92 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 15 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 201.23 |
| LogP ≤ 5 | 1.83 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of N-(4-imidazol-1-ylphenyl)acetamide?
The IUPAC name of N-(4-imidazol-1-ylphenyl)acetamide (CID 16761727) is N-(4-imidazol-1-ylphenyl)acetamide.
What is the SMILES notation for N-(4-imidazol-1-ylphenyl)acetamide?
The canonical SMILES for N-(4-imidazol-1-ylphenyl)acetamide is CC(=O)Nc1ccc(-n2ccnc2)cc1.
What is the InChIKey of N-(4-imidazol-1-ylphenyl)acetamide?
The InChIKey is SLCNHWPKGYFGIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11N3O/c1-9(15)13-10-2-4-11(5-3-10)14-7-6-12-8-14/h2-8H,1H3,(H,13,15).
What are the key properties of N-(4-imidazol-1-ylphenyl)acetamide?
N-(4-imidazol-1-ylphenyl)acetamide has a molecular weight of 201.23 g/mol, XLogP of 1.83, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-imidazol-1-ylphenyl)acetamide is sourced from PubChem (CID 16761727), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).