About 6-methoxy-N-(2-propylsulfonylethyl)pyridin-3-amine
6-methoxy-N-(2-propylsulfonylethyl)pyridin-3-amine (PubChem CID 106722892) has the molecular formula C11H18N2O3S
and a molecular weight of 258.34 g/mol. Its IUPAC name is 6-methoxy-N-(2-propylsulfonylethyl)pyridin-3-amine.
Molecular Properties
| Compound Name | 6-methoxy-N-(2-propylsulfonylethyl)pyridin-3-amine |
| PubChem CID | 106722892 |
| Molecular Formula | C11H18N2O3S |
| Molecular Weight | 258.34 g/mol |
| Exact Mass | 258.10 |
| IUPAC Name | 6-methoxy-N-(2-propylsulfonylethyl)pyridin-3-amine |
| SMILES | CCCS(=O)(=O)CCNc1ccc(OC)nc1 |
| InChI | InChI=1S/C11H18N2O3S/c1-3-7-17(14,15)8-6-12-10-4-5-11(16-2)13-9-10/h4-5,9,12H,3,6-8H2,1-2H3 |
| InChIKey | JHGAJGOJWMYCOK-UHFFFAOYSA-N |
| XLogP | 1.33 |
| TPSA | 68.29 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Heavy Atoms | 17 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 258.34 |
| LogP ≤ 5 | 1.33 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 5 |
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Frequently Asked Questions
What is the IUPAC name of 6-methoxy-N-(2-propylsulfonylethyl)pyridin-3-amine?
The IUPAC name of 6-methoxy-N-(2-propylsulfonylethyl)pyridin-3-amine (CID 106722892) is 6-methoxy-N-(2-propylsulfonylethyl)pyridin-3-amine.
What is the SMILES notation for 6-methoxy-N-(2-propylsulfonylethyl)pyridin-3-amine?
The canonical SMILES for 6-methoxy-N-(2-propylsulfonylethyl)pyridin-3-amine is CCCS(=O)(=O)CCNc1ccc(OC)nc1.
What is the InChIKey of 6-methoxy-N-(2-propylsulfonylethyl)pyridin-3-amine?
The InChIKey is JHGAJGOJWMYCOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O3S/c1-3-7-17(14,15)8-6-12-10-4-5-11(16-2)13-9-10/h4-5,9,12H,3,6-8H2,1-2H3.
What are the key properties of 6-methoxy-N-(2-propylsulfonylethyl)pyridin-3-amine?
6-methoxy-N-(2-propylsulfonylethyl)pyridin-3-amine has a molecular weight of 258.34 g/mol, XLogP of 1.33, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-N-(2-propylsulfonylethyl)pyridin-3-amine is sourced from PubChem (CID 106722892), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).