4-(4-ethoxyphenyl)-1-(2-oxopropyl)imidazolidin-2-one

C14H18N2O3 — CID 116980486

IUPAC4-(4-ethoxyphenyl)-1-(2-oxopropyl)imidazolidin-2-one
SMILESCCOc1ccc(C2CN(CC(C)=O)C(=O)N2)cc1
InChIInChI=1S/C14H18N2O3/c1-3-19-12-6-4-11(5-7-12)13-9-16(8-10(2)17)14(18)15-13/h4-7,13H,3,8-9H2,1-2H3,(H,15,18)
InChIKeyQKHSGCYVFLPZRM-UHFFFAOYSA-N
MW262.31 g/mol
LogP1.74
Rot. Bonds5

About 4-(4-ethoxyphenyl)-1-(2-oxopropyl)imidazolidin-2-one

4-(4-ethoxyphenyl)-1-(2-oxopropyl)imidazolidin-2-one (PubChem CID 116980486) has the molecular formula C14H18N2O3 and a molecular weight of 262.31 g/mol. Its IUPAC name is 4-(4-ethoxyphenyl)-1-(2-oxopropyl)imidazolidin-2-one.

Molecular Properties

Compound Name4-(4-ethoxyphenyl)-1-(2-oxopropyl)imidazolidin-2-one
PubChem CID116980486
Molecular FormulaC14H18N2O3
Molecular Weight262.31 g/mol
Exact Mass262.13
IUPAC Name4-(4-ethoxyphenyl)-1-(2-oxopropyl)imidazolidin-2-one
SMILESCCOc1ccc(C2CN(CC(C)=O)C(=O)N2)cc1
InChIInChI=1S/C14H18N2O3/c1-3-19-12-6-4-11(5-7-12)13-9-16(8-10(2)17)14(18)15-13/h4-7,13H,3,8-9H2,1-2H3,(H,15,18)
InChIKeyQKHSGCYVFLPZRM-UHFFFAOYSA-N
XLogP1.74
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.31
LogP ≤ 51.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-(4-ethoxyphenyl)-1-(2-oxopropyl)imidazolidin-2-one?
The IUPAC name of 4-(4-ethoxyphenyl)-1-(2-oxopropyl)imidazolidin-2-one (CID 116980486) is 4-(4-ethoxyphenyl)-1-(2-oxopropyl)imidazolidin-2-one.
What is the SMILES notation for 4-(4-ethoxyphenyl)-1-(2-oxopropyl)imidazolidin-2-one?
The canonical SMILES for 4-(4-ethoxyphenyl)-1-(2-oxopropyl)imidazolidin-2-one is CCOc1ccc(C2CN(CC(C)=O)C(=O)N2)cc1.
What is the InChIKey of 4-(4-ethoxyphenyl)-1-(2-oxopropyl)imidazolidin-2-one?
The InChIKey is QKHSGCYVFLPZRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O3/c1-3-19-12-6-4-11(5-7-12)13-9-16(8-10(2)17)14(18)15-13/h4-7,13H,3,8-9H2,1-2H3,(H,15,18).
What are the key properties of 4-(4-ethoxyphenyl)-1-(2-oxopropyl)imidazolidin-2-one?
4-(4-ethoxyphenyl)-1-(2-oxopropyl)imidazolidin-2-one has a molecular weight of 262.31 g/mol, XLogP of 1.74, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-ethoxyphenyl)-1-(2-oxopropyl)imidazolidin-2-one is sourced from PubChem (CID 116980486), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).