About N-(9H-fluoren-1-yl)-1-phenylethanimine
N-(9H-fluoren-1-yl)-1-phenylethanimine (PubChem CID 143688268) has the molecular formula C21H17N
and a molecular weight of 283.37 g/mol. Its IUPAC name is N-(9H-fluoren-1-yl)-1-phenylethanimine.
Molecular Properties
| Compound Name | N-(9H-fluoren-1-yl)-1-phenylethanimine |
| PubChem CID | 143688268 |
| Molecular Formula | C21H17N |
| Molecular Weight | 283.37 g/mol |
| Exact Mass | 283.14 |
| IUPAC Name | N-(9H-fluoren-1-yl)-1-phenylethanimine |
| SMILES | C/C(=N\c1cccc2c1Cc1ccccc1-2)c1ccccc1 |
| InChI | InChI=1S/C21H17N/c1-15(16-8-3-2-4-9-16)22-21-13-7-12-19-18-11-6-5-10-17(18)14-20(19)21/h2-13H,14H2,1H3/b22-15+ |
| InChIKey | YNRHSZQJQUNDJC-PXLXIMEGSA-N |
| XLogP | 5.40 |
| TPSA | 12.36 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 22 |
| Complexity | — |
Lipinski Rule of Five
1 violation
| Rule | Value |
| MW ≤ 500 | 283.37 |
| LogP ≤ 5 | 5.40 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 1 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'imine_1', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of N-(9H-fluoren-1-yl)-1-phenylethanimine?
The IUPAC name of N-(9H-fluoren-1-yl)-1-phenylethanimine (CID 143688268) is N-(9H-fluoren-1-yl)-1-phenylethanimine.
What is the SMILES notation for N-(9H-fluoren-1-yl)-1-phenylethanimine?
The canonical SMILES for N-(9H-fluoren-1-yl)-1-phenylethanimine is C/C(=N\c1cccc2c1Cc1ccccc1-2)c1ccccc1.
What is the InChIKey of N-(9H-fluoren-1-yl)-1-phenylethanimine?
The InChIKey is YNRHSZQJQUNDJC-PXLXIMEGSA-N. The full InChI is InChI=1S/C21H17N/c1-15(16-8-3-2-4-9-16)22-21-13-7-12-19-18-11-6-5-10-17(18)14-20(19)21/h2-13H,14H2,1H3/b22-15+.
What are the key properties of N-(9H-fluoren-1-yl)-1-phenylethanimine?
N-(9H-fluoren-1-yl)-1-phenylethanimine has a molecular weight of 283.37 g/mol, XLogP of 5.40, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(9H-fluoren-1-yl)-1-phenylethanimine is sourced from PubChem (CID 143688268), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).