3-ethyl-5-methyl-2-(4-prop-2-enoxyphenyl)imidazolidin-4-one

C15H20N2O2 — CID 115282177

IUPAC3-ethyl-5-methyl-2-(4-prop-2-enoxyphenyl)imidazolidin-4-one
SMILESC=CCOc1ccc(C2NC(C)C(=O)N2CC)cc1
InChIInChI=1S/C15H20N2O2/c1-4-10-19-13-8-6-12(7-9-13)14-16-11(3)15(18)17(14)5-2/h4,6-9,11,14,16H,1,5,10H2,2-3H3
InChIKeyBANAHUONSXBCEU-UHFFFAOYSA-N
MW260.34 g/mol
LogP2.09
Rot. Bonds5

About 3-ethyl-5-methyl-2-(4-prop-2-enoxyphenyl)imidazolidin-4-one

3-ethyl-5-methyl-2-(4-prop-2-enoxyphenyl)imidazolidin-4-one (PubChem CID 115282177) has the molecular formula C15H20N2O2 and a molecular weight of 260.34 g/mol. Its IUPAC name is 3-ethyl-5-methyl-2-(4-prop-2-enoxyphenyl)imidazolidin-4-one.

Molecular Properties

Compound Name3-ethyl-5-methyl-2-(4-prop-2-enoxyphenyl)imidazolidin-4-one
PubChem CID115282177
Molecular FormulaC15H20N2O2
Molecular Weight260.34 g/mol
Exact Mass260.15
IUPAC Name3-ethyl-5-methyl-2-(4-prop-2-enoxyphenyl)imidazolidin-4-one
SMILESC=CCOc1ccc(C2NC(C)C(=O)N2CC)cc1
InChIInChI=1S/C15H20N2O2/c1-4-10-19-13-8-6-12(7-9-13)14-16-11(3)15(18)17(14)5-2/h4,6-9,11,14,16H,1,5,10H2,2-3H3
InChIKeyBANAHUONSXBCEU-UHFFFAOYSA-N
XLogP2.09
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.34
LogP ≤ 52.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

3-(2,2-difluoroethyl)-5-methyl-2-(4-prop-2-enoxyphenyl)imidazolidin-4-one
CID 83268492
2-(4-ethoxyphenyl)-3,5-diethylimidazolidin-4-one
CID 83238704
3-ethyl-5-methyl-2-(4-propan-2-ylphenyl)imidazolidin-4-one
CID 115282163
2-(4-methoxyphenyl)-5-methyl-3-pentylimidazolidin-4-one
CID 83250631
2-(4-methoxyphenyl)-5-methyl-3-(2-methylbutyl)imidazolidin-4-one
CID 83252895
2-(4-fluorophenyl)-5-methyl-3-propylimidazolidin-4-one
CID 115282121
3-ethyl-2-(4-methoxyphenyl)-5-(2-methylpropyl)imidazolidin-4-one
CID 83239781
3-(2,2-dimethylcyclopropyl)-2-(4-prop-2-enoxyphenyl)imidazolidin-4-one
CID 83248628
2-(4-chlorophenyl)-3-(2-ethoxyethyl)-5-methylimidazolidin-4-one
CID 83236742
2-(4-prop-2-enoxyphenyl)-3-(2,2,2-trifluoroethyl)imidazolidin-4-one
CID 115282346
5-butyl-3-ethyl-2-(4-methoxyphenyl)imidazolidin-4-one
CID 83239253
5-methyl-2-(4-propan-2-ylphenyl)-3-propylimidazolidin-4-one
CID 115282125

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-5-methyl-2-(4-prop-2-enoxyphenyl)imidazolidin-4-one?
The IUPAC name of 3-ethyl-5-methyl-2-(4-prop-2-enoxyphenyl)imidazolidin-4-one (CID 115282177) is 3-ethyl-5-methyl-2-(4-prop-2-enoxyphenyl)imidazolidin-4-one.
What is the SMILES notation for 3-ethyl-5-methyl-2-(4-prop-2-enoxyphenyl)imidazolidin-4-one?
The canonical SMILES for 3-ethyl-5-methyl-2-(4-prop-2-enoxyphenyl)imidazolidin-4-one is C=CCOc1ccc(C2NC(C)C(=O)N2CC)cc1.
What is the InChIKey of 3-ethyl-5-methyl-2-(4-prop-2-enoxyphenyl)imidazolidin-4-one?
The InChIKey is BANAHUONSXBCEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O2/c1-4-10-19-13-8-6-12(7-9-13)14-16-11(3)15(18)17(14)5-2/h4,6-9,11,14,16H,1,5,10H2,2-3H3.
What are the key properties of 3-ethyl-5-methyl-2-(4-prop-2-enoxyphenyl)imidazolidin-4-one?
3-ethyl-5-methyl-2-(4-prop-2-enoxyphenyl)imidazolidin-4-one has a molecular weight of 260.34 g/mol, XLogP of 2.09, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-5-methyl-2-(4-prop-2-enoxyphenyl)imidazolidin-4-one is sourced from PubChem (CID 115282177), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).