About N-[(Z)-2-(6-methylcyclohex-3-en-1-yl)ethenyl]methanimine
N-[(Z)-2-(6-methylcyclohex-3-en-1-yl)ethenyl]methanimine (PubChem CID 130390394) has the molecular formula C10H15N
and a molecular weight of 149.24 g/mol. Its IUPAC name is N-[(Z)-2-(6-methylcyclohex-3-en-1-yl)ethenyl]methanimine.
Molecular Properties
| Compound Name | N-[(Z)-2-(6-methylcyclohex-3-en-1-yl)ethenyl]methanimine |
| PubChem CID | 130390394 |
| Molecular Formula | C10H15N |
| Molecular Weight | 149.24 g/mol |
| Exact Mass | 149.12 |
| IUPAC Name | N-[(Z)-2-(6-methylcyclohex-3-en-1-yl)ethenyl]methanimine |
| SMILES | C=N/C=C\C1CC=CCC1C |
| InChI | InChI=1S/C10H15N/c1-9-5-3-4-6-10(9)7-8-11-2/h3-4,7-10H,2,5-6H2,1H3/b8-7- |
| InChIKey | LQAINNZGBLWQDH-FPLPWBNLSA-N |
| XLogP | 2.80 |
| TPSA | 12.36 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 11 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 149.24 |
| LogP ≤ 5 | 2.80 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 1 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of N-[(Z)-2-(6-methylcyclohex-3-en-1-yl)ethenyl]methanimine?
The IUPAC name of N-[(Z)-2-(6-methylcyclohex-3-en-1-yl)ethenyl]methanimine (CID 130390394) is N-[(Z)-2-(6-methylcyclohex-3-en-1-yl)ethenyl]methanimine.
What is the SMILES notation for N-[(Z)-2-(6-methylcyclohex-3-en-1-yl)ethenyl]methanimine?
The canonical SMILES for N-[(Z)-2-(6-methylcyclohex-3-en-1-yl)ethenyl]methanimine is C=N/C=C\C1CC=CCC1C.
What is the InChIKey of N-[(Z)-2-(6-methylcyclohex-3-en-1-yl)ethenyl]methanimine?
The InChIKey is LQAINNZGBLWQDH-FPLPWBNLSA-N. The full InChI is InChI=1S/C10H15N/c1-9-5-3-4-6-10(9)7-8-11-2/h3-4,7-10H,2,5-6H2,1H3/b8-7-.
What are the key properties of N-[(Z)-2-(6-methylcyclohex-3-en-1-yl)ethenyl]methanimine?
N-[(Z)-2-(6-methylcyclohex-3-en-1-yl)ethenyl]methanimine has a molecular weight of 149.24 g/mol, XLogP of 2.80, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(Z)-2-(6-methylcyclohex-3-en-1-yl)ethenyl]methanimine is sourced from PubChem (CID 130390394), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).