About 4-[2-(2-methoxyethoxy)ethoxy]pyridin-3-amine
4-[2-(2-methoxyethoxy)ethoxy]pyridin-3-amine (PubChem CID 104559949) has the molecular formula C10H16N2O3
and a molecular weight of 212.25 g/mol. Its IUPAC name is 4-[2-(2-methoxyethoxy)ethoxy]pyridin-3-amine.
Molecular Properties
| Compound Name | 4-[2-(2-methoxyethoxy)ethoxy]pyridin-3-amine |
| PubChem CID | 104559949 |
| Molecular Formula | C10H16N2O3 |
| Molecular Weight | 212.25 g/mol |
| Exact Mass | 212.12 |
| IUPAC Name | 4-[2-(2-methoxyethoxy)ethoxy]pyridin-3-amine |
| SMILES | COCCOCCOc1ccncc1N |
| InChI | InChI=1S/C10H16N2O3/c1-13-4-5-14-6-7-15-10-2-3-12-8-9(10)11/h2-3,8H,4-7,11H2,1H3 |
| InChIKey | WBINTZFMDMTRIH-UHFFFAOYSA-N |
| XLogP | 0.71 |
| TPSA | 66.60 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Heavy Atoms | 15 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 212.25 |
| LogP ≤ 5 | 0.71 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 5 |
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 4-[2-(2-methoxyethoxy)ethoxy]pyridin-3-amine?
The IUPAC name of 4-[2-(2-methoxyethoxy)ethoxy]pyridin-3-amine (CID 104559949) is 4-[2-(2-methoxyethoxy)ethoxy]pyridin-3-amine.
What is the SMILES notation for 4-[2-(2-methoxyethoxy)ethoxy]pyridin-3-amine?
The canonical SMILES for 4-[2-(2-methoxyethoxy)ethoxy]pyridin-3-amine is COCCOCCOc1ccncc1N.
What is the InChIKey of 4-[2-(2-methoxyethoxy)ethoxy]pyridin-3-amine?
The InChIKey is WBINTZFMDMTRIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O3/c1-13-4-5-14-6-7-15-10-2-3-12-8-9(10)11/h2-3,8H,4-7,11H2,1H3.
What are the key properties of 4-[2-(2-methoxyethoxy)ethoxy]pyridin-3-amine?
4-[2-(2-methoxyethoxy)ethoxy]pyridin-3-amine has a molecular weight of 212.25 g/mol, XLogP of 0.71, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(2-methoxyethoxy)ethoxy]pyridin-3-amine is sourced from PubChem (CID 104559949), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).