About 4-methyl-6-(2-methyl-4H-imidazol-5-yl)pyridine-3-carbonitrile
4-methyl-6-(2-methyl-4H-imidazol-5-yl)pyridine-3-carbonitrile (PubChem CID 166906275) has the molecular formula C11H10N4
and a molecular weight of 198.23 g/mol. Its IUPAC name is 4-methyl-6-(2-methyl-4H-imidazol-5-yl)pyridine-3-carbonitrile.
Molecular Properties
| Compound Name | 4-methyl-6-(2-methyl-4H-imidazol-5-yl)pyridine-3-carbonitrile |
| PubChem CID | 166906275 |
| Molecular Formula | C11H10N4 |
| Molecular Weight | 198.23 g/mol |
| Exact Mass | 198.09 |
| IUPAC Name | 4-methyl-6-(2-methyl-4H-imidazol-5-yl)pyridine-3-carbonitrile |
| SMILES | CC1=NCC(c2cc(C)c(C#N)cn2)=N1 |
| InChI | InChI=1S/C11H10N4/c1-7-3-10(14-5-9(7)4-12)11-6-13-8(2)15-11/h3,5H,6H2,1-2H3 |
| InChIKey | UGYKIZFAUCFSTJ-UHFFFAOYSA-N |
| XLogP | 1.48 |
| TPSA | 61.40 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Heavy Atoms | 15 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 198.23 |
| LogP ≤ 5 | 1.48 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 4 |
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Frequently Asked Questions
What is the IUPAC name of 4-methyl-6-(2-methyl-4H-imidazol-5-yl)pyridine-3-carbonitrile?
The IUPAC name of 4-methyl-6-(2-methyl-4H-imidazol-5-yl)pyridine-3-carbonitrile (CID 166906275) is 4-methyl-6-(2-methyl-4H-imidazol-5-yl)pyridine-3-carbonitrile.
What is the SMILES notation for 4-methyl-6-(2-methyl-4H-imidazol-5-yl)pyridine-3-carbonitrile?
The canonical SMILES for 4-methyl-6-(2-methyl-4H-imidazol-5-yl)pyridine-3-carbonitrile is CC1=NCC(c2cc(C)c(C#N)cn2)=N1.
What is the InChIKey of 4-methyl-6-(2-methyl-4H-imidazol-5-yl)pyridine-3-carbonitrile?
The InChIKey is UGYKIZFAUCFSTJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10N4/c1-7-3-10(14-5-9(7)4-12)11-6-13-8(2)15-11/h3,5H,6H2,1-2H3.
What are the key properties of 4-methyl-6-(2-methyl-4H-imidazol-5-yl)pyridine-3-carbonitrile?
4-methyl-6-(2-methyl-4H-imidazol-5-yl)pyridine-3-carbonitrile has a molecular weight of 198.23 g/mol, XLogP of 1.48, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-6-(2-methyl-4H-imidazol-5-yl)pyridine-3-carbonitrile is sourced from PubChem (CID 166906275), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).