About 6-morpholin-4-yl-N-[(E)-1-morpholin-4-ylpropan-2-ylideneamino]pyridazin-3-amine
6-morpholin-4-yl-N-[(E)-1-morpholin-4-ylpropan-2-ylideneamino]pyridazin-3-amine (PubChem CID 13382926) has the molecular formula C15H24N6O2
and a molecular weight of 320.40 g/mol. Its IUPAC name is 6-morpholin-4-yl-N-[(E)-1-morpholin-4-ylpropan-2-ylideneamino]pyridazin-3-amine.
Molecular Properties
| Compound Name | 6-morpholin-4-yl-N-[(E)-1-morpholin-4-ylpropan-2-ylideneamino]pyridazin-3-amine |
| PubChem CID | 13382926 |
| Molecular Formula | C15H24N6O2 |
| Molecular Weight | 320.40 g/mol |
| Exact Mass | 320.20 |
| IUPAC Name | 6-morpholin-4-yl-N-[(E)-1-morpholin-4-ylpropan-2-ylideneamino]pyridazin-3-amine |
| SMILES | C/C(CN1CCOCC1)=N\Nc1ccc(N2CCOCC2)nn1 |
| InChI | InChI=1S/C15H24N6O2/c1-13(12-20-4-8-22-9-5-20)16-17-14-2-3-15(19-18-14)21-6-10-23-11-7-21/h2-3H,4-12H2,1H3,(H,17,18)/b16-13+ |
| InChIKey | XALWBXQCTWTTSZ-DTQAZKPQSA-N |
| XLogP | 0.43 |
| TPSA | 75.11 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 8 |
| Rotatable Bonds | 5 |
| Heavy Atoms | 23 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 320.40 |
| LogP ≤ 5 | 0.43 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 8 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'imine_1', '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 6-morpholin-4-yl-N-[(E)-1-morpholin-4-ylpropan-2-ylideneamino]pyridazin-3-amine?
The IUPAC name of 6-morpholin-4-yl-N-[(E)-1-morpholin-4-ylpropan-2-ylideneamino]pyridazin-3-amine (CID 13382926) is 6-morpholin-4-yl-N-[(E)-1-morpholin-4-ylpropan-2-ylideneamino]pyridazin-3-amine.
What is the SMILES notation for 6-morpholin-4-yl-N-[(E)-1-morpholin-4-ylpropan-2-ylideneamino]pyridazin-3-amine?
The canonical SMILES for 6-morpholin-4-yl-N-[(E)-1-morpholin-4-ylpropan-2-ylideneamino]pyridazin-3-amine is C/C(CN1CCOCC1)=N\Nc1ccc(N2CCOCC2)nn1.
What is the InChIKey of 6-morpholin-4-yl-N-[(E)-1-morpholin-4-ylpropan-2-ylideneamino]pyridazin-3-amine?
The InChIKey is XALWBXQCTWTTSZ-DTQAZKPQSA-N. The full InChI is InChI=1S/C15H24N6O2/c1-13(12-20-4-8-22-9-5-20)16-17-14-2-3-15(19-18-14)21-6-10-23-11-7-21/h2-3H,4-12H2,1H3,(H,17,18)/b16-13+.
What are the key properties of 6-morpholin-4-yl-N-[(E)-1-morpholin-4-ylpropan-2-ylideneamino]pyridazin-3-amine?
6-morpholin-4-yl-N-[(E)-1-morpholin-4-ylpropan-2-ylideneamino]pyridazin-3-amine has a molecular weight of 320.40 g/mol, XLogP of 0.43, 5 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 6-morpholin-4-yl-N-[(E)-1-morpholin-4-ylpropan-2-ylideneamino]pyridazin-3-amine is sourced from PubChem (CID 13382926), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).