About (E)-N-[4-(9H-fluoren-9-yl)piperazin-1-yl]-1-pyridin-3-ylethanimine
(E)-N-[4-(9H-fluoren-9-yl)piperazin-1-yl]-1-pyridin-3-ylethanimine (PubChem CID 5351068) has the molecular formula C24H24N4
and a molecular weight of 368.48 g/mol. Its IUPAC name is (E)-N-[4-(9H-fluoren-9-yl)piperazin-1-yl]-1-pyridin-3-ylethanimine.
Molecular Properties
| Compound Name | (E)-N-[4-(9H-fluoren-9-yl)piperazin-1-yl]-1-pyridin-3-ylethanimine |
| PubChem CID | 5351068 |
| Molecular Formula | C24H24N4 |
| Molecular Weight | 368.48 g/mol |
| Exact Mass | 368.20 |
| IUPAC Name | (E)-N-[4-(9H-fluoren-9-yl)piperazin-1-yl]-1-pyridin-3-ylethanimine |
| SMILES | C/C(=N\N1CCN(C2c3ccccc3-c3ccccc32)CC1)c1cccnc1 |
| InChI | InChI=1S/C24H24N4/c1-18(19-7-6-12-25-17-19)26-28-15-13-27(14-16-28)24-22-10-4-2-8-20(22)21-9-3-5-11-23(21)24/h2-12,17,24H,13-16H2,1H3/b26-18+ |
| InChIKey | LYRHBDYLHIRALJ-NLRVBDNBSA-N |
| XLogP | 4.19 |
| TPSA | 31.73 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 28 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 368.48 |
| LogP ≤ 5 | 4.19 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 4 |
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 (E)-N-[4-(9H-fluoren-9-yl)piperazin-1-yl]-1-pyridin-3-ylethanimine?
The IUPAC name of (E)-N-[4-(9H-fluoren-9-yl)piperazin-1-yl]-1-pyridin-3-ylethanimine (CID 5351068) is (E)-N-[4-(9H-fluoren-9-yl)piperazin-1-yl]-1-pyridin-3-ylethanimine.
What is the SMILES notation for (E)-N-[4-(9H-fluoren-9-yl)piperazin-1-yl]-1-pyridin-3-ylethanimine?
The canonical SMILES for (E)-N-[4-(9H-fluoren-9-yl)piperazin-1-yl]-1-pyridin-3-ylethanimine is C/C(=N\N1CCN(C2c3ccccc3-c3ccccc32)CC1)c1cccnc1.
What is the InChIKey of (E)-N-[4-(9H-fluoren-9-yl)piperazin-1-yl]-1-pyridin-3-ylethanimine?
The InChIKey is LYRHBDYLHIRALJ-NLRVBDNBSA-N. The full InChI is InChI=1S/C24H24N4/c1-18(19-7-6-12-25-17-19)26-28-15-13-27(14-16-28)24-22-10-4-2-8-20(22)21-9-3-5-11-23(21)24/h2-12,17,24H,13-16H2,1H3/b26-18+.
What are the key properties of (E)-N-[4-(9H-fluoren-9-yl)piperazin-1-yl]-1-pyridin-3-ylethanimine?
(E)-N-[4-(9H-fluoren-9-yl)piperazin-1-yl]-1-pyridin-3-ylethanimine has a molecular weight of 368.48 g/mol, XLogP of 4.19, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-N-[4-(9H-fluoren-9-yl)piperazin-1-yl]-1-pyridin-3-ylethanimine is sourced from PubChem (CID 5351068), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).