About N-[(Z)-(3-methoxyphenyl)methylideneamino]acetamide
N-[(Z)-(3-methoxyphenyl)methylideneamino]acetamide (PubChem CID 6011810) has the molecular formula C10H12N2O2
and a molecular weight of 192.22 g/mol. Its IUPAC name is N-[(Z)-(3-methoxyphenyl)methylideneamino]acetamide.
Molecular Properties
| Compound Name | N-[(Z)-(3-methoxyphenyl)methylideneamino]acetamide |
| PubChem CID | 6011810 |
| Molecular Formula | C10H12N2O2 |
| Molecular Weight | 192.22 g/mol |
| Exact Mass | 192.09 |
| IUPAC Name | N-[(Z)-(3-methoxyphenyl)methylideneamino]acetamide |
| SMILES | COc1cccc(/C=N\NC(C)=O)c1 |
| InChI | InChI=1S/C10H12N2O2/c1-8(13)12-11-7-9-4-3-5-10(6-9)14-2/h3-7H,1-2H3,(H,12,13)/b11-7- |
| InChIKey | HZOPARCQLLTSFR-XFFZJAGNSA-N |
| XLogP | 1.17 |
| TPSA | 50.69 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 14 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 192.22 |
| LogP ≤ 5 | 1.17 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 3 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'imine_1', '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-[(Z)-(3-methoxyphenyl)methylideneamino]acetamide?
The IUPAC name of N-[(Z)-(3-methoxyphenyl)methylideneamino]acetamide (CID 6011810) is N-[(Z)-(3-methoxyphenyl)methylideneamino]acetamide.
What is the SMILES notation for N-[(Z)-(3-methoxyphenyl)methylideneamino]acetamide?
The canonical SMILES for N-[(Z)-(3-methoxyphenyl)methylideneamino]acetamide is COc1cccc(/C=N\NC(C)=O)c1.
What is the InChIKey of N-[(Z)-(3-methoxyphenyl)methylideneamino]acetamide?
The InChIKey is HZOPARCQLLTSFR-XFFZJAGNSA-N. The full InChI is InChI=1S/C10H12N2O2/c1-8(13)12-11-7-9-4-3-5-10(6-9)14-2/h3-7H,1-2H3,(H,12,13)/b11-7-.
What are the key properties of N-[(Z)-(3-methoxyphenyl)methylideneamino]acetamide?
N-[(Z)-(3-methoxyphenyl)methylideneamino]acetamide has a molecular weight of 192.22 g/mol, XLogP of 1.17, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(Z)-(3-methoxyphenyl)methylideneamino]acetamide is sourced from PubChem (CID 6011810), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).