About 2-methoxy-N-(2-methoxyethyl)-6-methylaniline
2-methoxy-N-(2-methoxyethyl)-6-methylaniline (PubChem CID 131854932) has the molecular formula C11H17NO2
and a molecular weight of 195.26 g/mol. Its IUPAC name is 2-methoxy-N-(2-methoxyethyl)-6-methylaniline.
Molecular Properties
| Compound Name | 2-methoxy-N-(2-methoxyethyl)-6-methylaniline |
| PubChem CID | 131854932 |
| Molecular Formula | C11H17NO2 |
| Molecular Weight | 195.26 g/mol |
| Exact Mass | 195.13 |
| IUPAC Name | 2-methoxy-N-(2-methoxyethyl)-6-methylaniline |
| SMILES | COCCNc1c(C)cccc1OC |
| InChI | InChI=1S/C11H17NO2/c1-9-5-4-6-10(14-3)11(9)12-7-8-13-2/h4-6,12H,7-8H2,1-3H3 |
| InChIKey | UCPOCUJZDOEQNR-UHFFFAOYSA-N |
| XLogP | 2.06 |
| TPSA | 30.49 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Heavy Atoms | 14 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 195.26 |
| LogP ≤ 5 | 2.06 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 3 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of 2-methoxy-N-(2-methoxyethyl)-6-methylaniline?
The IUPAC name of 2-methoxy-N-(2-methoxyethyl)-6-methylaniline (CID 131854932) is 2-methoxy-N-(2-methoxyethyl)-6-methylaniline.
What is the SMILES notation for 2-methoxy-N-(2-methoxyethyl)-6-methylaniline?
The canonical SMILES for 2-methoxy-N-(2-methoxyethyl)-6-methylaniline is COCCNc1c(C)cccc1OC.
What is the InChIKey of 2-methoxy-N-(2-methoxyethyl)-6-methylaniline?
The InChIKey is UCPOCUJZDOEQNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NO2/c1-9-5-4-6-10(14-3)11(9)12-7-8-13-2/h4-6,12H,7-8H2,1-3H3.
What are the key properties of 2-methoxy-N-(2-methoxyethyl)-6-methylaniline?
2-methoxy-N-(2-methoxyethyl)-6-methylaniline has a molecular weight of 195.26 g/mol, XLogP of 2.06, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-(2-methoxyethyl)-6-methylaniline is sourced from PubChem (CID 131854932), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).