About N,4-dimethyl-3H-pyridin-6-imine
N,4-dimethyl-3H-pyridin-6-imine (PubChem CID 123755468) has the molecular formula C7H10N2
and a molecular weight of 122.17 g/mol. Its IUPAC name is N,4-dimethyl-3H-pyridin-6-imine.
Molecular Properties
| Compound Name | N,4-dimethyl-3H-pyridin-6-imine |
| PubChem CID | 123755468 |
| Molecular Formula | C7H10N2 |
| Molecular Weight | 122.17 g/mol |
| Exact Mass | 122.08 |
| IUPAC Name | N,4-dimethyl-3H-pyridin-6-imine |
| SMILES | C/N=C1/C=C(C)CC=N1 |
| InChI | InChI=1S/C7H10N2/c1-6-3-4-9-7(5-6)8-2/h4-5H,3H2,1-2H3/b8-7- |
| InChIKey | SCSAIAZVHABDGQ-FPLPWBNLSA-N |
| XLogP | 1.44 |
| TPSA | 24.72 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | |
| Heavy Atoms | 9 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 122.17 |
| LogP ≤ 5 | 1.44 |
| 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,4-dimethyl-3H-pyridin-6-imine?
The IUPAC name of N,4-dimethyl-3H-pyridin-6-imine (CID 123755468) is N,4-dimethyl-3H-pyridin-6-imine.
What is the SMILES notation for N,4-dimethyl-3H-pyridin-6-imine?
The canonical SMILES for N,4-dimethyl-3H-pyridin-6-imine is C/N=C1/C=C(C)CC=N1.
What is the InChIKey of N,4-dimethyl-3H-pyridin-6-imine?
The InChIKey is SCSAIAZVHABDGQ-FPLPWBNLSA-N. The full InChI is InChI=1S/C7H10N2/c1-6-3-4-9-7(5-6)8-2/h4-5H,3H2,1-2H3/b8-7-.
What are the key properties of N,4-dimethyl-3H-pyridin-6-imine?
N,4-dimethyl-3H-pyridin-6-imine has a molecular weight of 122.17 g/mol, XLogP of 1.44, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,4-dimethyl-3H-pyridin-6-imine is sourced from PubChem (CID 123755468), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).