About N-[methyl(oxido)amino]oxymethanamine
N-[methyl(oxido)amino]oxymethanamine (PubChem CID 163663501) has the molecular formula C2H7N2O2-
and a molecular weight of 91.09 g/mol. Its IUPAC name is N-[methyl(oxido)amino]oxymethanamine.
Molecular Properties
| Compound Name | N-[methyl(oxido)amino]oxymethanamine |
| PubChem CID | 163663501 |
| Molecular Formula | C2H7N2O2- |
| Molecular Weight | 91.09 g/mol |
| Exact Mass | 91.05 |
| IUPAC Name | N-[methyl(oxido)amino]oxymethanamine |
| SMILES | CNON(C)[O-] |
| InChI | InChI=1S/C2H7N2O2/c1-3-6-4(2)5/h3H,1-2H3/q-1 |
| InChIKey | WKLSIMGZTGLSLR-UHFFFAOYSA-N |
| XLogP | -0.52 |
| TPSA | 47.56 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 6 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 91.09 |
| LogP ≤ 5 | -0.52 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 4 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'} |
|---|
Analyze N-[methyl(oxido)amino]oxymethanamine with MolForge
Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.
Launch Full Analysis
Frequently Asked Questions
What is the IUPAC name of N-[methyl(oxido)amino]oxymethanamine?
The IUPAC name of N-[methyl(oxido)amino]oxymethanamine (CID 163663501) is N-[methyl(oxido)amino]oxymethanamine.
What is the SMILES notation for N-[methyl(oxido)amino]oxymethanamine?
The canonical SMILES for N-[methyl(oxido)amino]oxymethanamine is CNON(C)[O-].
What is the InChIKey of N-[methyl(oxido)amino]oxymethanamine?
The InChIKey is WKLSIMGZTGLSLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H7N2O2/c1-3-6-4(2)5/h3H,1-2H3/q-1.
What are the key properties of N-[methyl(oxido)amino]oxymethanamine?
N-[methyl(oxido)amino]oxymethanamine has a molecular weight of 91.09 g/mol, XLogP of -0.52, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[methyl(oxido)amino]oxymethanamine is sourced from PubChem (CID 163663501), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).