About ethyl 2-[methyl(methylamino)amino]acetate
ethyl 2-[methyl(methylamino)amino]acetate (PubChem CID 10606882) has the molecular formula C6H14N2O2
and a molecular weight of 146.19 g/mol. Its IUPAC name is ethyl 2-[methyl(methylamino)amino]acetate.
Molecular Properties
| Compound Name | ethyl 2-[methyl(methylamino)amino]acetate |
| PubChem CID | 10606882 |
| Molecular Formula | C6H14N2O2 |
| Molecular Weight | 146.19 g/mol |
| Exact Mass | 146.11 |
| IUPAC Name | ethyl 2-[methyl(methylamino)amino]acetate |
| SMILES | CCOC(=O)CN(C)NC |
| InChI | InChI=1S/C6H14N2O2/c1-4-10-6(9)5-8(3)7-2/h7H,4-5H2,1-3H3 |
| InChIKey | WABNXQRVTLOFTL-UHFFFAOYSA-N |
| XLogP | -0.38 |
| TPSA | 41.57 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 10 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 146.19 |
| LogP ≤ 5 | -0.38 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 4 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of ethyl 2-[methyl(methylamino)amino]acetate?
The IUPAC name of ethyl 2-[methyl(methylamino)amino]acetate (CID 10606882) is ethyl 2-[methyl(methylamino)amino]acetate.
What is the SMILES notation for ethyl 2-[methyl(methylamino)amino]acetate?
The canonical SMILES for ethyl 2-[methyl(methylamino)amino]acetate is CCOC(=O)CN(C)NC.
What is the InChIKey of ethyl 2-[methyl(methylamino)amino]acetate?
The InChIKey is WABNXQRVTLOFTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H14N2O2/c1-4-10-6(9)5-8(3)7-2/h7H,4-5H2,1-3H3.
What are the key properties of ethyl 2-[methyl(methylamino)amino]acetate?
ethyl 2-[methyl(methylamino)amino]acetate has a molecular weight of 146.19 g/mol, XLogP of -0.38, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 2-[methyl(methylamino)amino]acetate is sourced from PubChem (CID 10606882), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).