About 3-methyl-2-methylidene-4-naphthalen-2-yl-1H-imidazole
3-methyl-2-methylidene-4-naphthalen-2-yl-1H-imidazole (PubChem CID 130219940) has the molecular formula C15H14N2
and a molecular weight of 222.29 g/mol. Its IUPAC name is 3-methyl-2-methylidene-4-naphthalen-2-yl-1H-imidazole.
Molecular Properties
| Compound Name | 3-methyl-2-methylidene-4-naphthalen-2-yl-1H-imidazole |
| PubChem CID | 130219940 |
| Molecular Formula | C15H14N2 |
| Molecular Weight | 222.29 g/mol |
| Exact Mass | 222.12 |
| IUPAC Name | 3-methyl-2-methylidene-4-naphthalen-2-yl-1H-imidazole |
| SMILES | C=C1NC=C(c2ccc3ccccc3c2)N1C |
| InChI | InChI=1S/C15H14N2/c1-11-16-10-15(17(11)2)14-8-7-12-5-3-4-6-13(12)9-14/h3-10,16H,1H2,2H3 |
| InChIKey | BHGOZEHAHYIHBY-UHFFFAOYSA-N |
| XLogP | 3.14 |
| TPSA | 15.27 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Heavy Atoms | 17 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 222.29 |
| LogP ≤ 5 | 3.14 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of 3-methyl-2-methylidene-4-naphthalen-2-yl-1H-imidazole?
The IUPAC name of 3-methyl-2-methylidene-4-naphthalen-2-yl-1H-imidazole (CID 130219940) is 3-methyl-2-methylidene-4-naphthalen-2-yl-1H-imidazole.
What is the SMILES notation for 3-methyl-2-methylidene-4-naphthalen-2-yl-1H-imidazole?
The canonical SMILES for 3-methyl-2-methylidene-4-naphthalen-2-yl-1H-imidazole is C=C1NC=C(c2ccc3ccccc3c2)N1C.
What is the InChIKey of 3-methyl-2-methylidene-4-naphthalen-2-yl-1H-imidazole?
The InChIKey is BHGOZEHAHYIHBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N2/c1-11-16-10-15(17(11)2)14-8-7-12-5-3-4-6-13(12)9-14/h3-10,16H,1H2,2H3.
What are the key properties of 3-methyl-2-methylidene-4-naphthalen-2-yl-1H-imidazole?
3-methyl-2-methylidene-4-naphthalen-2-yl-1H-imidazole has a molecular weight of 222.29 g/mol, XLogP of 3.14, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-2-methylidene-4-naphthalen-2-yl-1H-imidazole is sourced from PubChem (CID 130219940), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).