About O-[2-[5-(2-methoxyethoxy)-3-[2-(2-methoxyethoxy)ethyl]pentoxy]ethyl]hydroxylamine
O-[2-[5-(2-methoxyethoxy)-3-[2-(2-methoxyethoxy)ethyl]pentoxy]ethyl]hydroxylamine (PubChem CID 166068197) has the molecular formula C15H33NO6
and a molecular weight of 323.43 g/mol. Its IUPAC name is O-[2-[5-(2-methoxyethoxy)-3-[2-(2-methoxyethoxy)ethyl]pentoxy]ethyl]hydroxylamine.
Molecular Properties
| Compound Name | O-[2-[5-(2-methoxyethoxy)-3-[2-(2-methoxyethoxy)ethyl]pentoxy]ethyl]hydroxylamine |
| PubChem CID | 166068197 |
| Molecular Formula | C15H33NO6 |
| Molecular Weight | 323.43 g/mol |
| Exact Mass | 323.23 |
| IUPAC Name | O-[2-[5-(2-methoxyethoxy)-3-[2-(2-methoxyethoxy)ethyl]pentoxy]ethyl]hydroxylamine |
| SMILES | COCCOCCC(CCOCCOC)CCOCCON |
| InChI | InChI=1S/C15H33NO6/c1-17-9-11-19-6-3-15(4-7-20-12-10-18-2)5-8-21-13-14-22-16/h15H,3-14,16H2,1-2H3 |
| InChIKey | IIXYUDMPSXWYCF-UHFFFAOYSA-N |
| XLogP | 1.01 |
| TPSA | 81.40 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 7 |
| Rotatable Bonds | 18 |
| Heavy Atoms | 22 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 323.43 |
| LogP ≤ 5 | 1.01 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 7 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of O-[2-[5-(2-methoxyethoxy)-3-[2-(2-methoxyethoxy)ethyl]pentoxy]ethyl]hydroxylamine?
The IUPAC name of O-[2-[5-(2-methoxyethoxy)-3-[2-(2-methoxyethoxy)ethyl]pentoxy]ethyl]hydroxylamine (CID 166068197) is O-[2-[5-(2-methoxyethoxy)-3-[2-(2-methoxyethoxy)ethyl]pentoxy]ethyl]hydroxylamine.
What is the SMILES notation for O-[2-[5-(2-methoxyethoxy)-3-[2-(2-methoxyethoxy)ethyl]pentoxy]ethyl]hydroxylamine?
The canonical SMILES for O-[2-[5-(2-methoxyethoxy)-3-[2-(2-methoxyethoxy)ethyl]pentoxy]ethyl]hydroxylamine is COCCOCCC(CCOCCOC)CCOCCON.
What is the InChIKey of O-[2-[5-(2-methoxyethoxy)-3-[2-(2-methoxyethoxy)ethyl]pentoxy]ethyl]hydroxylamine?
The InChIKey is IIXYUDMPSXWYCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H33NO6/c1-17-9-11-19-6-3-15(4-7-20-12-10-18-2)5-8-21-13-14-22-16/h15H,3-14,16H2,1-2H3.
What are the key properties of O-[2-[5-(2-methoxyethoxy)-3-[2-(2-methoxyethoxy)ethyl]pentoxy]ethyl]hydroxylamine?
O-[2-[5-(2-methoxyethoxy)-3-[2-(2-methoxyethoxy)ethyl]pentoxy]ethyl]hydroxylamine has a molecular weight of 323.43 g/mol, XLogP of 1.01, 18 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for O-[2-[5-(2-methoxyethoxy)-3-[2-(2-methoxyethoxy)ethyl]pentoxy]ethyl]hydroxylamine is sourced from PubChem (CID 166068197), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).