About [oxan-4-yl(quinoxalin-5-yl)methyl]hydrazine
[oxan-4-yl(quinoxalin-5-yl)methyl]hydrazine (PubChem CID 105306260) has the molecular formula C14H18N4O
and a molecular weight of 258.32 g/mol. Its IUPAC name is [oxan-4-yl(quinoxalin-5-yl)methyl]hydrazine.
Molecular Properties
| Compound Name | [oxan-4-yl(quinoxalin-5-yl)methyl]hydrazine |
| PubChem CID | 105306260 |
| Molecular Formula | C14H18N4O |
| Molecular Weight | 258.32 g/mol |
| Exact Mass | 258.15 |
| IUPAC Name | [oxan-4-yl(quinoxalin-5-yl)methyl]hydrazine |
| SMILES | NNC(c1cccc2nccnc12)C1CCOCC1 |
| InChI | InChI=1S/C14H18N4O/c15-18-13(10-4-8-19-9-5-10)11-2-1-3-12-14(11)17-7-6-16-12/h1-3,6-7,10,13,18H,4-5,8-9,15H2 |
| InChIKey | UBEXDTDPXFIFCV-UHFFFAOYSA-N |
| XLogP | 1.56 |
| TPSA | 73.06 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 19 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 258.32 |
| LogP ≤ 5 | 1.56 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 5 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'hydrazine', '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 [oxan-4-yl(quinoxalin-5-yl)methyl]hydrazine?
The IUPAC name of [oxan-4-yl(quinoxalin-5-yl)methyl]hydrazine (CID 105306260) is [oxan-4-yl(quinoxalin-5-yl)methyl]hydrazine.
What is the SMILES notation for [oxan-4-yl(quinoxalin-5-yl)methyl]hydrazine?
The canonical SMILES for [oxan-4-yl(quinoxalin-5-yl)methyl]hydrazine is NNC(c1cccc2nccnc12)C1CCOCC1.
What is the InChIKey of [oxan-4-yl(quinoxalin-5-yl)methyl]hydrazine?
The InChIKey is UBEXDTDPXFIFCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4O/c15-18-13(10-4-8-19-9-5-10)11-2-1-3-12-14(11)17-7-6-16-12/h1-3,6-7,10,13,18H,4-5,8-9,15H2.
What are the key properties of [oxan-4-yl(quinoxalin-5-yl)methyl]hydrazine?
[oxan-4-yl(quinoxalin-5-yl)methyl]hydrazine has a molecular weight of 258.32 g/mol, XLogP of 1.56, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [oxan-4-yl(quinoxalin-5-yl)methyl]hydrazine is sourced from PubChem (CID 105306260), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).