About 4-cyclopropyl-1-methylpyridin-2-imine
4-cyclopropyl-1-methylpyridin-2-imine (PubChem CID 139498811) has the molecular formula C9H12N2
and a molecular weight of 148.21 g/mol. Its IUPAC name is 4-cyclopropyl-1-methylpyridin-2-imine.
Molecular Properties
| Compound Name | 4-cyclopropyl-1-methylpyridin-2-imine |
| PubChem CID | 139498811 |
| Molecular Formula | C9H12N2 |
| Molecular Weight | 148.21 g/mol |
| Exact Mass | 148.10 |
| IUPAC Name | 4-cyclopropyl-1-methylpyridin-2-imine |
| SMILES | [H]/N=c1\cc(C2CC2)ccn1C |
| InChI | InChI=1S/C9H12N2/c1-11-5-4-8(6-9(11)10)7-2-3-7/h4-7,10H,2-3H2,1H3/b10-9+ |
| InChIKey | OMPSJRHDFFMPKM-MDZDMXLPSA-N |
| XLogP | 1.38 |
| TPSA | 28.78 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Heavy Atoms | 11 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 148.21 |
| LogP ≤ 5 | 1.38 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of 4-cyclopropyl-1-methylpyridin-2-imine?
The IUPAC name of 4-cyclopropyl-1-methylpyridin-2-imine (CID 139498811) is 4-cyclopropyl-1-methylpyridin-2-imine.
What is the SMILES notation for 4-cyclopropyl-1-methylpyridin-2-imine?
The canonical SMILES for 4-cyclopropyl-1-methylpyridin-2-imine is [H]/N=c1\cc(C2CC2)ccn1C.
What is the InChIKey of 4-cyclopropyl-1-methylpyridin-2-imine?
The InChIKey is OMPSJRHDFFMPKM-MDZDMXLPSA-N. The full InChI is InChI=1S/C9H12N2/c1-11-5-4-8(6-9(11)10)7-2-3-7/h4-7,10H,2-3H2,1H3/b10-9+.
What are the key properties of 4-cyclopropyl-1-methylpyridin-2-imine?
4-cyclopropyl-1-methylpyridin-2-imine has a molecular weight of 148.21 g/mol, XLogP of 1.38, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclopropyl-1-methylpyridin-2-imine is sourced from PubChem (CID 139498811), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).