About 1-[4-(4-methylpiperazin-1-yl)phenyl]-2-(4-morpholin-4-ylphenyl)hydrazine
1-[4-(4-methylpiperazin-1-yl)phenyl]-2-(4-morpholin-4-ylphenyl)hydrazine (PubChem CID 123306233) has the molecular formula C21H29N5O
and a molecular weight of 367.50 g/mol. Its IUPAC name is 1-[4-(4-methylpiperazin-1-yl)phenyl]-2-(4-morpholin-4-ylphenyl)hydrazine.
Molecular Properties
| Compound Name | 1-[4-(4-methylpiperazin-1-yl)phenyl]-2-(4-morpholin-4-ylphenyl)hydrazine |
| PubChem CID | 123306233 |
| Molecular Formula | C21H29N5O |
| Molecular Weight | 367.50 g/mol |
| Exact Mass | 367.24 |
| IUPAC Name | 1-[4-(4-methylpiperazin-1-yl)phenyl]-2-(4-morpholin-4-ylphenyl)hydrazine |
| SMILES | CN1CCN(c2ccc(NNc3ccc(N4CCOCC4)cc3)cc2)CC1 |
| InChI | InChI=1S/C21H29N5O/c1-24-10-12-25(13-11-24)20-6-2-18(3-7-20)22-23-19-4-8-21(9-5-19)26-14-16-27-17-15-26/h2-9,22-23H,10-17H2,1H3 |
| InChIKey | JFOKPNZUEOCNHL-UHFFFAOYSA-N |
| XLogP | 2.71 |
| TPSA | 43.01 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 6 |
| Rotatable Bonds | 5 |
| Heavy Atoms | 27 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 367.50 |
| LogP ≤ 5 | 2.71 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 6 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'anil_di_alk_A(478)', '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 1-[4-(4-methylpiperazin-1-yl)phenyl]-2-(4-morpholin-4-ylphenyl)hydrazine?
The IUPAC name of 1-[4-(4-methylpiperazin-1-yl)phenyl]-2-(4-morpholin-4-ylphenyl)hydrazine (CID 123306233) is 1-[4-(4-methylpiperazin-1-yl)phenyl]-2-(4-morpholin-4-ylphenyl)hydrazine.
What is the SMILES notation for 1-[4-(4-methylpiperazin-1-yl)phenyl]-2-(4-morpholin-4-ylphenyl)hydrazine?
The canonical SMILES for 1-[4-(4-methylpiperazin-1-yl)phenyl]-2-(4-morpholin-4-ylphenyl)hydrazine is CN1CCN(c2ccc(NNc3ccc(N4CCOCC4)cc3)cc2)CC1.
What is the InChIKey of 1-[4-(4-methylpiperazin-1-yl)phenyl]-2-(4-morpholin-4-ylphenyl)hydrazine?
The InChIKey is JFOKPNZUEOCNHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H29N5O/c1-24-10-12-25(13-11-24)20-6-2-18(3-7-20)22-23-19-4-8-21(9-5-19)26-14-16-27-17-15-26/h2-9,22-23H,10-17H2,1H3.
What are the key properties of 1-[4-(4-methylpiperazin-1-yl)phenyl]-2-(4-morpholin-4-ylphenyl)hydrazine?
1-[4-(4-methylpiperazin-1-yl)phenyl]-2-(4-morpholin-4-ylphenyl)hydrazine has a molecular weight of 367.50 g/mol, XLogP of 2.71, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[4-(4-methylpiperazin-1-yl)phenyl]-2-(4-morpholin-4-ylphenyl)hydrazine is sourced from PubChem (CID 123306233), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).