5-ethyl-3,5-dimethyl-2-(3-methylphenyl)imidazolidin-4-one

C14H20N2O — CID 83260407

IUPAC5-ethyl-3,5-dimethyl-2-(3-methylphenyl)imidazolidin-4-one
SMILESCCC1(C)NC(c2cccc(C)c2)N(C)C1=O
InChIInChI=1S/C14H20N2O/c1-5-14(3)13(17)16(4)12(15-14)11-8-6-7-10(2)9-11/h6-9,12,15H,5H2,1-4H3
InChIKeyDVGBKTFWHNNXBP-UHFFFAOYSA-N
MW232.33 g/mol
LogP2.22
Rot. Bonds2

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

5-ethyl-3,5-dimethyl-2-(3-methylphenyl)imidazolidin-4-one (PubChem CID 83260407) has the molecular formula C14H20N2O and a molecular weight of 232.33 g/mol. Its IUPAC name is 5-ethyl-3,5-dimethyl-2-(3-methylphenyl)imidazolidin-4-one.

Molecular Properties

Compound Name5-ethyl-3,5-dimethyl-2-(3-methylphenyl)imidazolidin-4-one
PubChem CID83260407
Molecular FormulaC14H20N2O
Molecular Weight232.33 g/mol
Exact Mass232.16
IUPAC Name5-ethyl-3,5-dimethyl-2-(3-methylphenyl)imidazolidin-4-one
SMILESCCC1(C)NC(c2cccc(C)c2)N(C)C1=O
InChIInChI=1S/C14H20N2O/c1-5-14(3)13(17)16(4)12(15-14)11-8-6-7-10(2)9-11/h6-9,12,15H,5H2,1-4H3
InChIKeyDVGBKTFWHNNXBP-UHFFFAOYSA-N
XLogP2.22
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.33
LogP ≤ 52.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-ethyl-3,5-dimethyl-2-(3-methylphenyl)imidazolidin-4-one?
The IUPAC name of 5-ethyl-3,5-dimethyl-2-(3-methylphenyl)imidazolidin-4-one (CID 83260407) is 5-ethyl-3,5-dimethyl-2-(3-methylphenyl)imidazolidin-4-one.
What is the SMILES notation for 5-ethyl-3,5-dimethyl-2-(3-methylphenyl)imidazolidin-4-one?
The canonical SMILES for 5-ethyl-3,5-dimethyl-2-(3-methylphenyl)imidazolidin-4-one is CCC1(C)NC(c2cccc(C)c2)N(C)C1=O.
What is the InChIKey of 5-ethyl-3,5-dimethyl-2-(3-methylphenyl)imidazolidin-4-one?
The InChIKey is DVGBKTFWHNNXBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O/c1-5-14(3)13(17)16(4)12(15-14)11-8-6-7-10(2)9-11/h6-9,12,15H,5H2,1-4H3.
What are the key properties of 5-ethyl-3,5-dimethyl-2-(3-methylphenyl)imidazolidin-4-one?
5-ethyl-3,5-dimethyl-2-(3-methylphenyl)imidazolidin-4-one has a molecular weight of 232.33 g/mol, XLogP of 2.22, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-3,5-dimethyl-2-(3-methylphenyl)imidazolidin-4-one is sourced from PubChem (CID 83260407), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).