About 2-[(2-methylphenyl)methylamino]oxyacetamide
2-[(2-methylphenyl)methylamino]oxyacetamide (PubChem CID 112672645) has the molecular formula C10H14N2O2
and a molecular weight of 194.23 g/mol. Its IUPAC name is 2-[(2-methylphenyl)methylamino]oxyacetamide.
Molecular Properties
| Compound Name | 2-[(2-methylphenyl)methylamino]oxyacetamide |
| PubChem CID | 112672645 |
| Molecular Formula | C10H14N2O2 |
| Molecular Weight | 194.23 g/mol |
| Exact Mass | 194.11 |
| IUPAC Name | 2-[(2-methylphenyl)methylamino]oxyacetamide |
| SMILES | Cc1ccccc1CNOCC(N)=O |
| InChI | InChI=1S/C10H14N2O2/c1-8-4-2-3-5-9(8)6-12-14-7-10(11)13/h2-5,12H,6-7H2,1H3,(H2,11,13) |
| InChIKey | WZFNYSOZNSGVGI-UHFFFAOYSA-N |
| XLogP | 0.50 |
| TPSA | 64.35 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Heavy Atoms | 14 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 194.23 |
| LogP ≤ 5 | 0.50 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 3 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of 2-[(2-methylphenyl)methylamino]oxyacetamide?
The IUPAC name of 2-[(2-methylphenyl)methylamino]oxyacetamide (CID 112672645) is 2-[(2-methylphenyl)methylamino]oxyacetamide.
What is the SMILES notation for 2-[(2-methylphenyl)methylamino]oxyacetamide?
The canonical SMILES for 2-[(2-methylphenyl)methylamino]oxyacetamide is Cc1ccccc1CNOCC(N)=O.
What is the InChIKey of 2-[(2-methylphenyl)methylamino]oxyacetamide?
The InChIKey is WZFNYSOZNSGVGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N2O2/c1-8-4-2-3-5-9(8)6-12-14-7-10(11)13/h2-5,12H,6-7H2,1H3,(H2,11,13).
What are the key properties of 2-[(2-methylphenyl)methylamino]oxyacetamide?
2-[(2-methylphenyl)methylamino]oxyacetamide has a molecular weight of 194.23 g/mol, XLogP of 0.50, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-methylphenyl)methylamino]oxyacetamide is sourced from PubChem (CID 112672645), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).