About 7,8-dihydroquinolin-4-ylmethanimine
7,8-dihydroquinolin-4-ylmethanimine (PubChem CID 144615054) has the molecular formula C10H10N2
and a molecular weight of 158.20 g/mol. Its IUPAC name is 7,8-dihydroquinolin-4-ylmethanimine.
Molecular Properties
| Compound Name | 7,8-dihydroquinolin-4-ylmethanimine |
| PubChem CID | 144615054 |
| Molecular Formula | C10H10N2 |
| Molecular Weight | 158.20 g/mol |
| Exact Mass | 158.08 |
| IUPAC Name | 7,8-dihydroquinolin-4-ylmethanimine |
| SMILES | [H]/N=C/c1ccnc2c1C=CCC2 |
| InChI | InChI=1S/C10H10N2/c11-7-8-5-6-12-10-4-2-1-3-9(8)10/h1,3,5-7,11H,2,4H2/b11-7+ |
| InChIKey | LOOGKWBSQZFEON-YRNVUSSQSA-N |
| XLogP | 2.04 |
| TPSA | 36.74 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Heavy Atoms | 12 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 158.20 |
| LogP ≤ 5 | 2.04 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 2 |
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 7,8-dihydroquinolin-4-ylmethanimine?
The IUPAC name of 7,8-dihydroquinolin-4-ylmethanimine (CID 144615054) is 7,8-dihydroquinolin-4-ylmethanimine.
What is the SMILES notation for 7,8-dihydroquinolin-4-ylmethanimine?
The canonical SMILES for 7,8-dihydroquinolin-4-ylmethanimine is [H]/N=C/c1ccnc2c1C=CCC2.
What is the InChIKey of 7,8-dihydroquinolin-4-ylmethanimine?
The InChIKey is LOOGKWBSQZFEON-YRNVUSSQSA-N. The full InChI is InChI=1S/C10H10N2/c11-7-8-5-6-12-10-4-2-1-3-9(8)10/h1,3,5-7,11H,2,4H2/b11-7+.
What are the key properties of 7,8-dihydroquinolin-4-ylmethanimine?
7,8-dihydroquinolin-4-ylmethanimine has a molecular weight of 158.20 g/mol, XLogP of 2.04, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7,8-dihydroquinolin-4-ylmethanimine is sourced from PubChem (CID 144615054), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).