About (Z)-N-[(Z)-(5-morpholin-4-ylthiophen-2-yl)methylideneamino]fluoren-9-imine
(Z)-N-[(Z)-(5-morpholin-4-ylthiophen-2-yl)methylideneamino]fluoren-9-imine (PubChem CID 8980480) has the molecular formula C22H19N3OS
and a molecular weight of 373.48 g/mol. Its IUPAC name is (Z)-N-[(Z)-(5-morpholin-4-ylthiophen-2-yl)methylideneamino]fluoren-9-imine.
Molecular Properties
| Compound Name | (Z)-N-[(Z)-(5-morpholin-4-ylthiophen-2-yl)methylideneamino]fluoren-9-imine |
| PubChem CID | 8980480 |
| Molecular Formula | C22H19N3OS |
| Molecular Weight | 373.48 g/mol |
| Exact Mass | 373.12 |
| IUPAC Name | (Z)-N-[(Z)-(5-morpholin-4-ylthiophen-2-yl)methylideneamino]fluoren-9-imine |
| SMILES | C(=N\N=C1c2ccccc2-c2ccccc21)\c1ccc(N2CCOCC2)s1 |
| InChI | InChI=1S/C22H19N3OS/c1-3-7-19-17(5-1)18-6-2-4-8-20(18)22(19)24-23-15-16-9-10-21(27-16)25-11-13-26-14-12-25/h1-10,15H,11-14H2/b23-15- |
| InChIKey | HKMCFDYZWSWOCG-HAHDFKILSA-N |
| XLogP | 4.44 |
| TPSA | 37.19 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 5 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 27 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 373.48 |
| LogP ≤ 5 | 4.44 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 5 |
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 (Z)-N-[(Z)-(5-morpholin-4-ylthiophen-2-yl)methylideneamino]fluoren-9-imine?
The IUPAC name of (Z)-N-[(Z)-(5-morpholin-4-ylthiophen-2-yl)methylideneamino]fluoren-9-imine (CID 8980480) is (Z)-N-[(Z)-(5-morpholin-4-ylthiophen-2-yl)methylideneamino]fluoren-9-imine.
What is the SMILES notation for (Z)-N-[(Z)-(5-morpholin-4-ylthiophen-2-yl)methylideneamino]fluoren-9-imine?
The canonical SMILES for (Z)-N-[(Z)-(5-morpholin-4-ylthiophen-2-yl)methylideneamino]fluoren-9-imine is C(=N\N=C1c2ccccc2-c2ccccc21)\c1ccc(N2CCOCC2)s1.
What is the InChIKey of (Z)-N-[(Z)-(5-morpholin-4-ylthiophen-2-yl)methylideneamino]fluoren-9-imine?
The InChIKey is HKMCFDYZWSWOCG-HAHDFKILSA-N. The full InChI is InChI=1S/C22H19N3OS/c1-3-7-19-17(5-1)18-6-2-4-8-20(18)22(19)24-23-15-16-9-10-21(27-16)25-11-13-26-14-12-25/h1-10,15H,11-14H2/b23-15-.
What are the key properties of (Z)-N-[(Z)-(5-morpholin-4-ylthiophen-2-yl)methylideneamino]fluoren-9-imine?
(Z)-N-[(Z)-(5-morpholin-4-ylthiophen-2-yl)methylideneamino]fluoren-9-imine has a molecular weight of 373.48 g/mol, XLogP of 4.44, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-N-[(Z)-(5-morpholin-4-ylthiophen-2-yl)methylideneamino]fluoren-9-imine is sourced from PubChem (CID 8980480), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).