About 2-(6-methoxy-4-methyl-3-pyridinyl)-N,N-dimethylethanamine
2-(6-methoxy-4-methyl-3-pyridinyl)-N,N-dimethylethanamine (PubChem CID 139579759) has the molecular formula C11H18N2O
and a molecular weight of 194.28 g/mol. Its IUPAC name is 2-(6-methoxy-4-methyl-3-pyridinyl)-N,N-dimethylethanamine.
Molecular Properties
| Compound Name | 2-(6-methoxy-4-methyl-3-pyridinyl)-N,N-dimethylethanamine |
| PubChem CID | 139579759 |
| Molecular Formula | C11H18N2O |
| Molecular Weight | 194.28 g/mol |
| Exact Mass | 194.14 |
| IUPAC Name | 2-(6-methoxy-4-methyl-3-pyridinyl)-N,N-dimethylethanamine |
| SMILES | COc1cc(C)c(CCN(C)C)cn1 |
| InChI | InChI=1S/C11H18N2O/c1-9-7-11(14-4)12-8-10(9)5-6-13(2)3/h7-8H,5-6H2,1-4H3 |
| InChIKey | WFYACIDDPIXGDZ-UHFFFAOYSA-N |
| XLogP | 1.50 |
| TPSA | 25.36 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 14 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 194.28 |
| LogP ≤ 5 | 1.50 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of 2-(6-methoxy-4-methyl-3-pyridinyl)-N,N-dimethylethanamine?
The IUPAC name of 2-(6-methoxy-4-methyl-3-pyridinyl)-N,N-dimethylethanamine (CID 139579759) is 2-(6-methoxy-4-methyl-3-pyridinyl)-N,N-dimethylethanamine.
What is the SMILES notation for 2-(6-methoxy-4-methyl-3-pyridinyl)-N,N-dimethylethanamine?
The canonical SMILES for 2-(6-methoxy-4-methyl-3-pyridinyl)-N,N-dimethylethanamine is COc1cc(C)c(CCN(C)C)cn1.
What is the InChIKey of 2-(6-methoxy-4-methyl-3-pyridinyl)-N,N-dimethylethanamine?
The InChIKey is WFYACIDDPIXGDZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O/c1-9-7-11(14-4)12-8-10(9)5-6-13(2)3/h7-8H,5-6H2,1-4H3.
What are the key properties of 2-(6-methoxy-4-methyl-3-pyridinyl)-N,N-dimethylethanamine?
2-(6-methoxy-4-methyl-3-pyridinyl)-N,N-dimethylethanamine has a molecular weight of 194.28 g/mol, XLogP of 1.50, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-methoxy-4-methyl-3-pyridinyl)-N,N-dimethylethanamine is sourced from PubChem (CID 139579759), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).