About morpholin-4-yl(phenazin-1-yl)methanone
morpholin-4-yl(phenazin-1-yl)methanone (PubChem CID 3743226) has the molecular formula C17H15N3O2
and a molecular weight of 293.33 g/mol. Its IUPAC name is morpholin-4-yl(phenazin-1-yl)methanone.
Molecular Properties
| Compound Name | morpholin-4-yl(phenazin-1-yl)methanone |
| PubChem CID | 3743226 |
| Molecular Formula | C17H15N3O2 |
| Molecular Weight | 293.33 g/mol |
| Exact Mass | 293.12 |
| IUPAC Name | morpholin-4-yl(phenazin-1-yl)methanone |
| SMILES | O=C(c1cccc2nc3ccccc3nc12)N1CCOCC1 |
| InChI | InChI=1S/C17H15N3O2/c21-17(20-8-10-22-11-9-20)12-4-3-7-15-16(12)19-14-6-2-1-5-13(14)18-15/h1-7H,8-11H2 |
| InChIKey | QZRMEVYMQXLDAI-UHFFFAOYSA-N |
| XLogP | 2.26 |
| TPSA | 55.32 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Heavy Atoms | 22 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 293.33 |
| LogP ≤ 5 | 2.26 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 4 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of morpholin-4-yl(phenazin-1-yl)methanone?
The IUPAC name of morpholin-4-yl(phenazin-1-yl)methanone (CID 3743226) is morpholin-4-yl(phenazin-1-yl)methanone.
What is the SMILES notation for morpholin-4-yl(phenazin-1-yl)methanone?
The canonical SMILES for morpholin-4-yl(phenazin-1-yl)methanone is O=C(c1cccc2nc3ccccc3nc12)N1CCOCC1.
What is the InChIKey of morpholin-4-yl(phenazin-1-yl)methanone?
The InChIKey is QZRMEVYMQXLDAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15N3O2/c21-17(20-8-10-22-11-9-20)12-4-3-7-15-16(12)19-14-6-2-1-5-13(14)18-15/h1-7H,8-11H2.
What are the key properties of morpholin-4-yl(phenazin-1-yl)methanone?
morpholin-4-yl(phenazin-1-yl)methanone has a molecular weight of 293.33 g/mol, XLogP of 2.26, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for morpholin-4-yl(phenazin-1-yl)methanone is sourced from PubChem (CID 3743226), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).