About 3-ethyl-5-(3-methylphenyl)-2-phenylimidazol-4-amine
3-ethyl-5-(3-methylphenyl)-2-phenylimidazol-4-amine (PubChem CID 62222262) has the molecular formula C18H19N3
and a molecular weight of 277.37 g/mol. Its IUPAC name is 3-ethyl-5-(3-methylphenyl)-2-phenylimidazol-4-amine.
Molecular Properties
| Compound Name | 3-ethyl-5-(3-methylphenyl)-2-phenylimidazol-4-amine |
| PubChem CID | 62222262 |
| Molecular Formula | C18H19N3 |
| Molecular Weight | 277.37 g/mol |
| Exact Mass | 277.16 |
| IUPAC Name | 3-ethyl-5-(3-methylphenyl)-2-phenylimidazol-4-amine |
| SMILES | CCn1c(-c2ccccc2)nc(-c2cccc(C)c2)c1N |
| InChI | InChI=1S/C18H19N3/c1-3-21-17(19)16(15-11-7-8-13(2)12-15)20-18(21)14-9-5-4-6-10-14/h4-12H,3,19H2,1-2H3 |
| InChIKey | DCYABSOOTVAXOR-UHFFFAOYSA-N |
| XLogP | 4.13 |
| TPSA | 43.84 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 21 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 277.37 |
| LogP ≤ 5 | 4.13 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of 3-ethyl-5-(3-methylphenyl)-2-phenylimidazol-4-amine?
The IUPAC name of 3-ethyl-5-(3-methylphenyl)-2-phenylimidazol-4-amine (CID 62222262) is 3-ethyl-5-(3-methylphenyl)-2-phenylimidazol-4-amine.
What is the SMILES notation for 3-ethyl-5-(3-methylphenyl)-2-phenylimidazol-4-amine?
The canonical SMILES for 3-ethyl-5-(3-methylphenyl)-2-phenylimidazol-4-amine is CCn1c(-c2ccccc2)nc(-c2cccc(C)c2)c1N.
What is the InChIKey of 3-ethyl-5-(3-methylphenyl)-2-phenylimidazol-4-amine?
The InChIKey is DCYABSOOTVAXOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19N3/c1-3-21-17(19)16(15-11-7-8-13(2)12-15)20-18(21)14-9-5-4-6-10-14/h4-12H,3,19H2,1-2H3.
What are the key properties of 3-ethyl-5-(3-methylphenyl)-2-phenylimidazol-4-amine?
3-ethyl-5-(3-methylphenyl)-2-phenylimidazol-4-amine has a molecular weight of 277.37 g/mol, XLogP of 4.13, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-5-(3-methylphenyl)-2-phenylimidazol-4-amine is sourced from PubChem (CID 62222262), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).