1-ethyl-4-(4-ethylphenyl)imidazolidin-2-one

C13H18N2O — CID 116980946

IUPAC1-ethyl-4-(4-ethylphenyl)imidazolidin-2-one
SMILESCCc1ccc(C2CN(CC)C(=O)N2)cc1
InChIInChI=1S/C13H18N2O/c1-3-10-5-7-11(8-6-10)12-9-15(4-2)13(16)14-12/h5-8,12H,3-4,9H2,1-2H3,(H,14,16)
InChIKeyCQIQPXOXHWAIGM-UHFFFAOYSA-N
MW218.30 g/mol
LogP2.34
Rot. Bonds3

About 1-ethyl-4-(4-ethylphenyl)imidazolidin-2-one

1-ethyl-4-(4-ethylphenyl)imidazolidin-2-one (PubChem CID 116980946) has the molecular formula C13H18N2O and a molecular weight of 218.30 g/mol. Its IUPAC name is 1-ethyl-4-(4-ethylphenyl)imidazolidin-2-one.

Molecular Properties

Compound Name1-ethyl-4-(4-ethylphenyl)imidazolidin-2-one
PubChem CID116980946
Molecular FormulaC13H18N2O
Molecular Weight218.30 g/mol
Exact Mass218.14
IUPAC Name1-ethyl-4-(4-ethylphenyl)imidazolidin-2-one
SMILESCCc1ccc(C2CN(CC)C(=O)N2)cc1
InChIInChI=1S/C13H18N2O/c1-3-10-5-7-11(8-6-10)12-9-15(4-2)13(16)14-12/h5-8,12H,3-4,9H2,1-2H3,(H,14,16)
InChIKeyCQIQPXOXHWAIGM-UHFFFAOYSA-N
XLogP2.34
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.30
LogP ≤ 52.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-ethyl-4-(4-ethylphenyl)imidazolidin-2-one?
The IUPAC name of 1-ethyl-4-(4-ethylphenyl)imidazolidin-2-one (CID 116980946) is 1-ethyl-4-(4-ethylphenyl)imidazolidin-2-one.
What is the SMILES notation for 1-ethyl-4-(4-ethylphenyl)imidazolidin-2-one?
The canonical SMILES for 1-ethyl-4-(4-ethylphenyl)imidazolidin-2-one is CCc1ccc(C2CN(CC)C(=O)N2)cc1.
What is the InChIKey of 1-ethyl-4-(4-ethylphenyl)imidazolidin-2-one?
The InChIKey is CQIQPXOXHWAIGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2O/c1-3-10-5-7-11(8-6-10)12-9-15(4-2)13(16)14-12/h5-8,12H,3-4,9H2,1-2H3,(H,14,16).
What are the key properties of 1-ethyl-4-(4-ethylphenyl)imidazolidin-2-one?
1-ethyl-4-(4-ethylphenyl)imidazolidin-2-one has a molecular weight of 218.30 g/mol, XLogP of 2.34, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-4-(4-ethylphenyl)imidazolidin-2-one is sourced from PubChem (CID 116980946), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).