About N-(5-azido-2-methoxyphenyl)acetamide
N-(5-azido-2-methoxyphenyl)acetamide (PubChem CID 151085292) has the molecular formula C9H10N4O2
and a molecular weight of 206.20 g/mol. Its IUPAC name is N-(5-azido-2-methoxyphenyl)acetamide.
Molecular Properties
| Compound Name | N-(5-azido-2-methoxyphenyl)acetamide |
| PubChem CID | 151085292 |
| Molecular Formula | C9H10N4O2 |
| Molecular Weight | 206.20 g/mol |
| Exact Mass | 206.08 |
| IUPAC Name | N-(5-azido-2-methoxyphenyl)acetamide |
| SMILES | COc1ccc(N=[N+]=[N-])cc1NC(C)=O |
| InChI | InChI=1S/C9H10N4O2/c1-6(14)11-8-5-7(12-13-10)3-4-9(8)15-2/h3-5H,1-2H3,(H,11,14) |
| InChIKey | MKZAABMNPKBZSI-UHFFFAOYSA-N |
| XLogP | 2.60 |
| TPSA | 87.09 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 15 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 206.20 |
| LogP ≤ 5 | 2.60 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 3 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'Azido_group', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_3', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of N-(5-azido-2-methoxyphenyl)acetamide?
The IUPAC name of N-(5-azido-2-methoxyphenyl)acetamide (CID 151085292) is N-(5-azido-2-methoxyphenyl)acetamide.
What is the SMILES notation for N-(5-azido-2-methoxyphenyl)acetamide?
The canonical SMILES for N-(5-azido-2-methoxyphenyl)acetamide is COc1ccc(N=[N+]=[N-])cc1NC(C)=O.
What is the InChIKey of N-(5-azido-2-methoxyphenyl)acetamide?
The InChIKey is MKZAABMNPKBZSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N4O2/c1-6(14)11-8-5-7(12-13-10)3-4-9(8)15-2/h3-5H,1-2H3,(H,11,14).
What are the key properties of N-(5-azido-2-methoxyphenyl)acetamide?
N-(5-azido-2-methoxyphenyl)acetamide has a molecular weight of 206.20 g/mol, XLogP of 2.60, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-azido-2-methoxyphenyl)acetamide is sourced from PubChem (CID 151085292), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).