About 5-morpholin-4-yl-2-(2-piperazin-1-ylethyl)pyridazin-3-one
5-morpholin-4-yl-2-(2-piperazin-1-ylethyl)pyridazin-3-one (PubChem CID 114395890) has the molecular formula C14H23N5O2
and a molecular weight of 293.37 g/mol. Its IUPAC name is 5-morpholin-4-yl-2-(2-piperazin-1-ylethyl)pyridazin-3-one.
Molecular Properties
| Compound Name | 5-morpholin-4-yl-2-(2-piperazin-1-ylethyl)pyridazin-3-one |
| PubChem CID | 114395890 |
| Molecular Formula | C14H23N5O2 |
| Molecular Weight | 293.37 g/mol |
| Exact Mass | 293.19 |
| IUPAC Name | 5-morpholin-4-yl-2-(2-piperazin-1-ylethyl)pyridazin-3-one |
| SMILES | O=c1cc(N2CCOCC2)cnn1CCN1CCNCC1 |
| InChI | InChI=1S/C14H23N5O2/c20-14-11-13(18-7-9-21-10-8-18)12-16-19(14)6-5-17-3-1-15-2-4-17/h11-12,15H,1-10H2 |
| InChIKey | YLWZOYFSPQHAPW-UHFFFAOYSA-N |
| XLogP | -1.01 |
| TPSA | 62.63 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 21 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 293.37 |
| LogP ≤ 5 | -1.01 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 7 |
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Frequently Asked Questions
What is the IUPAC name of 5-morpholin-4-yl-2-(2-piperazin-1-ylethyl)pyridazin-3-one?
The IUPAC name of 5-morpholin-4-yl-2-(2-piperazin-1-ylethyl)pyridazin-3-one (CID 114395890) is 5-morpholin-4-yl-2-(2-piperazin-1-ylethyl)pyridazin-3-one.
What is the SMILES notation for 5-morpholin-4-yl-2-(2-piperazin-1-ylethyl)pyridazin-3-one?
The canonical SMILES for 5-morpholin-4-yl-2-(2-piperazin-1-ylethyl)pyridazin-3-one is O=c1cc(N2CCOCC2)cnn1CCN1CCNCC1.
What is the InChIKey of 5-morpholin-4-yl-2-(2-piperazin-1-ylethyl)pyridazin-3-one?
The InChIKey is YLWZOYFSPQHAPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N5O2/c20-14-11-13(18-7-9-21-10-8-18)12-16-19(14)6-5-17-3-1-15-2-4-17/h11-12,15H,1-10H2.
What are the key properties of 5-morpholin-4-yl-2-(2-piperazin-1-ylethyl)pyridazin-3-one?
5-morpholin-4-yl-2-(2-piperazin-1-ylethyl)pyridazin-3-one has a molecular weight of 293.37 g/mol, XLogP of -1.01, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5-morpholin-4-yl-2-(2-piperazin-1-ylethyl)pyridazin-3-one is sourced from PubChem (CID 114395890), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).