About N-(4-hydroxy-2-methoxyphenyl)iminoacetamide
N-(4-hydroxy-2-methoxyphenyl)iminoacetamide (PubChem CID 135407237) has the molecular formula C9H10N2O3
and a molecular weight of 194.19 g/mol. Its IUPAC name is N-(4-hydroxy-2-methoxyphenyl)iminoacetamide.
Molecular Properties
| Compound Name | N-(4-hydroxy-2-methoxyphenyl)iminoacetamide |
| PubChem CID | 135407237 |
| Molecular Formula | C9H10N2O3 |
| Molecular Weight | 194.19 g/mol |
| Exact Mass | 194.07 |
| IUPAC Name | N-(4-hydroxy-2-methoxyphenyl)iminoacetamide |
| SMILES | COc1cc(O)ccc1/N=N/C(C)=O |
| InChI | InChI=1S/C9H10N2O3/c1-6(12)10-11-8-4-3-7(13)5-9(8)14-2/h3-5,13H,1-2H3/b11-10+ |
| InChIKey | DXSIKKGRZZGHHR-ZHACJKMWSA-N |
| XLogP | 2.03 |
| TPSA | 71.25 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 14 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 194.19 |
| LogP ≤ 5 | 2.03 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 4 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of N-(4-hydroxy-2-methoxyphenyl)iminoacetamide?
The IUPAC name of N-(4-hydroxy-2-methoxyphenyl)iminoacetamide (CID 135407237) is N-(4-hydroxy-2-methoxyphenyl)iminoacetamide.
What is the SMILES notation for N-(4-hydroxy-2-methoxyphenyl)iminoacetamide?
The canonical SMILES for N-(4-hydroxy-2-methoxyphenyl)iminoacetamide is COc1cc(O)ccc1/N=N/C(C)=O.
What is the InChIKey of N-(4-hydroxy-2-methoxyphenyl)iminoacetamide?
The InChIKey is DXSIKKGRZZGHHR-ZHACJKMWSA-N. The full InChI is InChI=1S/C9H10N2O3/c1-6(12)10-11-8-4-3-7(13)5-9(8)14-2/h3-5,13H,1-2H3/b11-10+.
What are the key properties of N-(4-hydroxy-2-methoxyphenyl)iminoacetamide?
N-(4-hydroxy-2-methoxyphenyl)iminoacetamide has a molecular weight of 194.19 g/mol, XLogP of 2.03, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-hydroxy-2-methoxyphenyl)iminoacetamide is sourced from PubChem (CID 135407237), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).