5-ethyl-3-methyl-2-(2-methylphenyl)imidazolidin-4-one

C13H18N2O — CID 83259790

IUPAC5-ethyl-3-methyl-2-(2-methylphenyl)imidazolidin-4-one
SMILESCCC1NC(c2ccccc2C)N(C)C1=O
InChIInChI=1S/C13H18N2O/c1-4-11-13(16)15(3)12(14-11)10-8-6-5-7-9(10)2/h5-8,11-12,14H,4H2,1-3H3
InChIKeyAMIXIJLTVQNLOH-UHFFFAOYSA-N
MW218.30 g/mol
LogP1.83
Rot. Bonds2

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

5-ethyl-3-methyl-2-(2-methylphenyl)imidazolidin-4-one (PubChem CID 83259790) has the molecular formula C13H18N2O and a molecular weight of 218.30 g/mol. Its IUPAC name is 5-ethyl-3-methyl-2-(2-methylphenyl)imidazolidin-4-one.

Molecular Properties

Compound Name5-ethyl-3-methyl-2-(2-methylphenyl)imidazolidin-4-one
PubChem CID83259790
Molecular FormulaC13H18N2O
Molecular Weight218.30 g/mol
Exact Mass218.14
IUPAC Name5-ethyl-3-methyl-2-(2-methylphenyl)imidazolidin-4-one
SMILESCCC1NC(c2ccccc2C)N(C)C1=O
InChIInChI=1S/C13H18N2O/c1-4-11-13(16)15(3)12(14-11)10-8-6-5-7-9(10)2/h5-8,11-12,14H,4H2,1-3H3
InChIKeyAMIXIJLTVQNLOH-UHFFFAOYSA-N
XLogP1.83
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.30
LogP ≤ 51.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-ethyl-3-methyl-2-(2-methylphenyl)imidazolidin-4-one?
The IUPAC name of 5-ethyl-3-methyl-2-(2-methylphenyl)imidazolidin-4-one (CID 83259790) is 5-ethyl-3-methyl-2-(2-methylphenyl)imidazolidin-4-one.
What is the SMILES notation for 5-ethyl-3-methyl-2-(2-methylphenyl)imidazolidin-4-one?
The canonical SMILES for 5-ethyl-3-methyl-2-(2-methylphenyl)imidazolidin-4-one is CCC1NC(c2ccccc2C)N(C)C1=O.
What is the InChIKey of 5-ethyl-3-methyl-2-(2-methylphenyl)imidazolidin-4-one?
The InChIKey is AMIXIJLTVQNLOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2O/c1-4-11-13(16)15(3)12(14-11)10-8-6-5-7-9(10)2/h5-8,11-12,14H,4H2,1-3H3.
What are the key properties of 5-ethyl-3-methyl-2-(2-methylphenyl)imidazolidin-4-one?
5-ethyl-3-methyl-2-(2-methylphenyl)imidazolidin-4-one has a molecular weight of 218.30 g/mol, XLogP of 1.83, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-3-methyl-2-(2-methylphenyl)imidazolidin-4-one is sourced from PubChem (CID 83259790), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).