About 5-benzyl-2-methyl-3-(2-methylcyclopropyl)imidazolidin-4-one
5-benzyl-2-methyl-3-(2-methylcyclopropyl)imidazolidin-4-one (PubChem CID 83254666) has the molecular formula C15H20N2O
and a molecular weight of 244.34 g/mol. Its IUPAC name is 5-benzyl-2-methyl-3-(2-methylcyclopropyl)imidazolidin-4-one.
Molecular Properties
| Compound Name | 5-benzyl-2-methyl-3-(2-methylcyclopropyl)imidazolidin-4-one |
| PubChem CID | 83254666 |
| Molecular Formula | C15H20N2O |
| Molecular Weight | 244.34 g/mol |
| Exact Mass | 244.16 |
| IUPAC Name | 5-benzyl-2-methyl-3-(2-methylcyclopropyl)imidazolidin-4-one |
| SMILES | CC1CC1N1C(=O)C(Cc2ccccc2)NC1C |
| InChI | InChI=1S/C15H20N2O/c1-10-8-14(10)17-11(2)16-13(15(17)18)9-12-6-4-3-5-7-12/h3-7,10-11,13-14,16H,8-9H2,1-2H3 |
| InChIKey | NEPVCVRDTCIMLS-UHFFFAOYSA-N |
| XLogP | 1.78 |
| TPSA | 32.34 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 18 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 244.34 |
| LogP ≤ 5 | 1.78 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of 5-benzyl-2-methyl-3-(2-methylcyclopropyl)imidazolidin-4-one?
The IUPAC name of 5-benzyl-2-methyl-3-(2-methylcyclopropyl)imidazolidin-4-one (CID 83254666) is 5-benzyl-2-methyl-3-(2-methylcyclopropyl)imidazolidin-4-one.
What is the SMILES notation for 5-benzyl-2-methyl-3-(2-methylcyclopropyl)imidazolidin-4-one?
The canonical SMILES for 5-benzyl-2-methyl-3-(2-methylcyclopropyl)imidazolidin-4-one is CC1CC1N1C(=O)C(Cc2ccccc2)NC1C.
What is the InChIKey of 5-benzyl-2-methyl-3-(2-methylcyclopropyl)imidazolidin-4-one?
The InChIKey is NEPVCVRDTCIMLS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O/c1-10-8-14(10)17-11(2)16-13(15(17)18)9-12-6-4-3-5-7-12/h3-7,10-11,13-14,16H,8-9H2,1-2H3.
What are the key properties of 5-benzyl-2-methyl-3-(2-methylcyclopropyl)imidazolidin-4-one?
5-benzyl-2-methyl-3-(2-methylcyclopropyl)imidazolidin-4-one has a molecular weight of 244.34 g/mol, XLogP of 1.78, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-benzyl-2-methyl-3-(2-methylcyclopropyl)imidazolidin-4-one is sourced from PubChem (CID 83254666), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).