About N-ethyl-N-methyl-2-(phenylmethoxyamino)acetamide
N-ethyl-N-methyl-2-(phenylmethoxyamino)acetamide (PubChem CID 64974385) has the molecular formula C12H18N2O2
and a molecular weight of 222.29 g/mol. Its IUPAC name is N-ethyl-N-methyl-2-(phenylmethoxyamino)acetamide.
Molecular Properties
| Compound Name | N-ethyl-N-methyl-2-(phenylmethoxyamino)acetamide |
| PubChem CID | 64974385 |
| Molecular Formula | C12H18N2O2 |
| Molecular Weight | 222.29 g/mol |
| Exact Mass | 222.14 |
| IUPAC Name | N-ethyl-N-methyl-2-(phenylmethoxyamino)acetamide |
| SMILES | CCN(C)C(=O)CNOCc1ccccc1 |
| InChI | InChI=1S/C12H18N2O2/c1-3-14(2)12(15)9-13-16-10-11-7-5-4-6-8-11/h4-8,13H,3,9-10H2,1-2H3 |
| InChIKey | VEDCTYUTDKPXRR-UHFFFAOYSA-N |
| XLogP | 1.19 |
| TPSA | 41.57 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Heavy Atoms | 16 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 222.29 |
| LogP ≤ 5 | 1.19 |
| H-Bond Donors ≤ 5 | 1 |
| 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 N-ethyl-N-methyl-2-(phenylmethoxyamino)acetamide?
The IUPAC name of N-ethyl-N-methyl-2-(phenylmethoxyamino)acetamide (CID 64974385) is N-ethyl-N-methyl-2-(phenylmethoxyamino)acetamide.
What is the SMILES notation for N-ethyl-N-methyl-2-(phenylmethoxyamino)acetamide?
The canonical SMILES for N-ethyl-N-methyl-2-(phenylmethoxyamino)acetamide is CCN(C)C(=O)CNOCc1ccccc1.
What is the InChIKey of N-ethyl-N-methyl-2-(phenylmethoxyamino)acetamide?
The InChIKey is VEDCTYUTDKPXRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O2/c1-3-14(2)12(15)9-13-16-10-11-7-5-4-6-8-11/h4-8,13H,3,9-10H2,1-2H3.
What are the key properties of N-ethyl-N-methyl-2-(phenylmethoxyamino)acetamide?
N-ethyl-N-methyl-2-(phenylmethoxyamino)acetamide has a molecular weight of 222.29 g/mol, XLogP of 1.19, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-methyl-2-(phenylmethoxyamino)acetamide is sourced from PubChem (CID 64974385), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).