About 5-methoxy-N-octan-4-ylpyridin-2-amine
5-methoxy-N-octan-4-ylpyridin-2-amine (PubChem CID 114138454) has the molecular formula C14H24N2O
and a molecular weight of 236.36 g/mol. Its IUPAC name is 5-methoxy-N-octan-4-ylpyridin-2-amine.
Molecular Properties
| Compound Name | 5-methoxy-N-octan-4-ylpyridin-2-amine |
| PubChem CID | 114138454 |
| Molecular Formula | C14H24N2O |
| Molecular Weight | 236.36 g/mol |
| Exact Mass | 236.19 |
| IUPAC Name | 5-methoxy-N-octan-4-ylpyridin-2-amine |
| SMILES | CCCCC(CCC)Nc1ccc(OC)cn1 |
| InChI | InChI=1S/C14H24N2O/c1-4-6-8-12(7-5-2)16-14-10-9-13(17-3)11-15-14/h9-12H,4-8H2,1-3H3,(H,15,16) |
| InChIKey | FEDNHAPQCKOZDL-UHFFFAOYSA-N |
| XLogP | 3.86 |
| TPSA | 34.15 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 8 |
| Heavy Atoms | 17 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 236.36 |
| LogP ≤ 5 | 3.86 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of 5-methoxy-N-octan-4-ylpyridin-2-amine?
The IUPAC name of 5-methoxy-N-octan-4-ylpyridin-2-amine (CID 114138454) is 5-methoxy-N-octan-4-ylpyridin-2-amine.
What is the SMILES notation for 5-methoxy-N-octan-4-ylpyridin-2-amine?
The canonical SMILES for 5-methoxy-N-octan-4-ylpyridin-2-amine is CCCCC(CCC)Nc1ccc(OC)cn1.
What is the InChIKey of 5-methoxy-N-octan-4-ylpyridin-2-amine?
The InChIKey is FEDNHAPQCKOZDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O/c1-4-6-8-12(7-5-2)16-14-10-9-13(17-3)11-15-14/h9-12H,4-8H2,1-3H3,(H,15,16).
What are the key properties of 5-methoxy-N-octan-4-ylpyridin-2-amine?
5-methoxy-N-octan-4-ylpyridin-2-amine has a molecular weight of 236.36 g/mol, XLogP of 3.86, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxy-N-octan-4-ylpyridin-2-amine is sourced from PubChem (CID 114138454), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).