5-ethyl-2-(3-fluorophenyl)-3-(1-methoxypropan-2-yl)imidazolidin-4-one

C15H21FN2O2 — CID 83240074

IUPAC5-ethyl-2-(3-fluorophenyl)-3-(1-methoxypropan-2-yl)imidazolidin-4-one
SMILESCCC1NC(c2cccc(F)c2)N(C(C)COC)C1=O
InChIInChI=1S/C15H21FN2O2/c1-4-13-15(19)18(10(2)9-20-3)14(17-13)11-6-5-7-12(16)8-11/h5-8,10,13-14,17H,4,9H2,1-3H3
InChIKeyQCCMBQXBXXDMIJ-UHFFFAOYSA-N
MW280.34 g/mol
LogP2.07
Rot. Bonds5

About 5-ethyl-2-(3-fluorophenyl)-3-(1-methoxypropan-2-yl)imidazolidin-4-one

5-ethyl-2-(3-fluorophenyl)-3-(1-methoxypropan-2-yl)imidazolidin-4-one (PubChem CID 83240074) has the molecular formula C15H21FN2O2 and a molecular weight of 280.34 g/mol. Its IUPAC name is 5-ethyl-2-(3-fluorophenyl)-3-(1-methoxypropan-2-yl)imidazolidin-4-one.

Molecular Properties

Compound Name5-ethyl-2-(3-fluorophenyl)-3-(1-methoxypropan-2-yl)imidazolidin-4-one
PubChem CID83240074
Molecular FormulaC15H21FN2O2
Molecular Weight280.34 g/mol
Exact Mass280.16
IUPAC Name5-ethyl-2-(3-fluorophenyl)-3-(1-methoxypropan-2-yl)imidazolidin-4-one
SMILESCCC1NC(c2cccc(F)c2)N(C(C)COC)C1=O
InChIInChI=1S/C15H21FN2O2/c1-4-13-15(19)18(10(2)9-20-3)14(17-13)11-6-5-7-12(16)8-11/h5-8,10,13-14,17H,4,9H2,1-3H3
InChIKeyQCCMBQXBXXDMIJ-UHFFFAOYSA-N
XLogP2.07
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.34
LogP ≤ 52.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-(1-methoxypropan-2-yl)-2-(3-methylphenyl)-5-propylimidazolidin-4-one
CID 83238139
5-ethyl-2-(3-fluorophenyl)-3-(4-methoxybutyl)imidazolidin-4-one
CID 83245843
5-(3-fluorophenyl)-6-(1-methoxypropan-2-yl)-4,6-diazaspiro[2.4]heptan-7-one
CID 83239801
5-ethyl-3-(4-methylpentan-2-yl)-2-(3-methylphenyl)imidazolidin-4-one
CID 83248284
5-butyl-3-(1-methoxypropan-2-yl)-2-phenylimidazolidin-4-one
CID 83237900
2-(2,4-difluorophenyl)-3-(1-methoxypropan-2-yl)-5-methylimidazolidin-4-one
CID 83239897
2-(3-chlorophenyl)-5-ethyl-3-hexan-2-ylimidazolidin-4-one
CID 83252025
3-(1-ethoxypropan-2-yl)-5-ethyl-2-(4-methylphenyl)imidazolidin-4-one
CID 83244890
2-(3-chlorophenyl)-5-ethyl-3-(3-methylpentan-2-yl)imidazolidin-4-one
CID 83247620
5-ethyl-3-(5-methylhexan-2-yl)-2-phenylimidazolidin-4-one
CID 83263251
2-(3-fluorophenyl)-3-pentan-3-yl-5-propan-2-ylimidazolidin-4-one
CID 83245919
2-(4-chlorophenyl)-3-(1-ethoxypropan-2-yl)-5-ethylimidazolidin-4-one
CID 83245870

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-2-(3-fluorophenyl)-3-(1-methoxypropan-2-yl)imidazolidin-4-one?
The IUPAC name of 5-ethyl-2-(3-fluorophenyl)-3-(1-methoxypropan-2-yl)imidazolidin-4-one (CID 83240074) is 5-ethyl-2-(3-fluorophenyl)-3-(1-methoxypropan-2-yl)imidazolidin-4-one.
What is the SMILES notation for 5-ethyl-2-(3-fluorophenyl)-3-(1-methoxypropan-2-yl)imidazolidin-4-one?
The canonical SMILES for 5-ethyl-2-(3-fluorophenyl)-3-(1-methoxypropan-2-yl)imidazolidin-4-one is CCC1NC(c2cccc(F)c2)N(C(C)COC)C1=O.
What is the InChIKey of 5-ethyl-2-(3-fluorophenyl)-3-(1-methoxypropan-2-yl)imidazolidin-4-one?
The InChIKey is QCCMBQXBXXDMIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21FN2O2/c1-4-13-15(19)18(10(2)9-20-3)14(17-13)11-6-5-7-12(16)8-11/h5-8,10,13-14,17H,4,9H2,1-3H3.
What are the key properties of 5-ethyl-2-(3-fluorophenyl)-3-(1-methoxypropan-2-yl)imidazolidin-4-one?
5-ethyl-2-(3-fluorophenyl)-3-(1-methoxypropan-2-yl)imidazolidin-4-one has a molecular weight of 280.34 g/mol, XLogP of 2.07, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-2-(3-fluorophenyl)-3-(1-methoxypropan-2-yl)imidazolidin-4-one is sourced from PubChem (CID 83240074), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).