3-(1-cyclopropylethyl)-5-ethyl-2-(3-fluorophenyl)-5-methylimidazolidin-4-one

C17H23FN2O — CID 83244740

IUPAC3-(1-cyclopropylethyl)-5-ethyl-2-(3-fluorophenyl)-5-methylimidazolidin-4-one
SMILESCCC1(C)NC(c2cccc(F)c2)N(C(C)C2CC2)C1=O
InChIInChI=1S/C17H23FN2O/c1-4-17(3)16(21)20(11(2)12-8-9-12)15(19-17)13-6-5-7-14(18)10-13/h5-7,10-12,15,19H,4,8-9H2,1-3H3
InChIKeyLIIHHUMNSSAWHF-UHFFFAOYSA-N
MW290.38 g/mol
LogP3.22
Rot. Bonds4

About 3-(1-cyclopropylethyl)-5-ethyl-2-(3-fluorophenyl)-5-methylimidazolidin-4-one

3-(1-cyclopropylethyl)-5-ethyl-2-(3-fluorophenyl)-5-methylimidazolidin-4-one (PubChem CID 83244740) has the molecular formula C17H23FN2O and a molecular weight of 290.38 g/mol. Its IUPAC name is 3-(1-cyclopropylethyl)-5-ethyl-2-(3-fluorophenyl)-5-methylimidazolidin-4-one.

Molecular Properties

Compound Name3-(1-cyclopropylethyl)-5-ethyl-2-(3-fluorophenyl)-5-methylimidazolidin-4-one
PubChem CID83244740
Molecular FormulaC17H23FN2O
Molecular Weight290.38 g/mol
Exact Mass290.18
IUPAC Name3-(1-cyclopropylethyl)-5-ethyl-2-(3-fluorophenyl)-5-methylimidazolidin-4-one
SMILESCCC1(C)NC(c2cccc(F)c2)N(C(C)C2CC2)C1=O
InChIInChI=1S/C17H23FN2O/c1-4-17(3)16(21)20(11(2)12-8-9-12)15(19-17)13-6-5-7-14(18)10-13/h5-7,10-12,15,19H,4,8-9H2,1-3H3
InChIKeyLIIHHUMNSSAWHF-UHFFFAOYSA-N
XLogP3.22
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.38
LogP ≤ 53.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-cyclobutyl-5-ethyl-2-(3-fluorophenyl)-5-methylimidazolidin-4-one
CID 83254488
3-(1-cyclopropylethyl)-5-ethyl-5-methyl-2-propan-2-ylimidazolidin-4-one
CID 83244454
3-(2-ethoxyethyl)-5-ethyl-2-(3-fluorophenyl)-5-methylimidazolidin-4-one
CID 83233386
2-(3-chlorophenyl)-5-ethyl-5-methyl-3-pentan-2-ylimidazolidin-4-one
CID 83238166
5-ethyl-2-(4-fluorophenyl)-5-methyl-3-(3-methylbutan-2-yl)imidazolidin-4-one
CID 83248492
5-(3-fluorophenyl)-6-(1-methoxypropan-2-yl)-4,6-diazaspiro[2.4]heptan-7-one
CID 83239801
3-(1-cyclohexylethyl)-5-ethyl-5-methyl-2-propan-2-ylimidazolidin-4-one
CID 83255507
5-(3-fluorophenyl)-6-(2-methylpropyl)-4,6-diazaspiro[2.4]heptan-7-one
CID 83242741
1-(1-cyclopropylethyl)-3-ethyl-3-methyl-6-propan-2-ylpiperazine-2,5-dione
CID 64960516
6-(1-cyclopentylethyl)-5-phenyl-4,6-diazaspiro[2.4]heptan-7-one
CID 83263091
(2S)-3-[(2R)-butan-2-yl]-2-(3-fluorophenyl)-1,2-dihydroquinazolin-4-one
CID 9008176
(2R)-3-[(2R)-butan-2-yl]-2-(3-fluorophenyl)-1,2-dihydroquinazolin-4-one
CID 9008174

Frequently Asked Questions

What is the IUPAC name of 3-(1-cyclopropylethyl)-5-ethyl-2-(3-fluorophenyl)-5-methylimidazolidin-4-one?
The IUPAC name of 3-(1-cyclopropylethyl)-5-ethyl-2-(3-fluorophenyl)-5-methylimidazolidin-4-one (CID 83244740) is 3-(1-cyclopropylethyl)-5-ethyl-2-(3-fluorophenyl)-5-methylimidazolidin-4-one.
What is the SMILES notation for 3-(1-cyclopropylethyl)-5-ethyl-2-(3-fluorophenyl)-5-methylimidazolidin-4-one?
The canonical SMILES for 3-(1-cyclopropylethyl)-5-ethyl-2-(3-fluorophenyl)-5-methylimidazolidin-4-one is CCC1(C)NC(c2cccc(F)c2)N(C(C)C2CC2)C1=O.
What is the InChIKey of 3-(1-cyclopropylethyl)-5-ethyl-2-(3-fluorophenyl)-5-methylimidazolidin-4-one?
The InChIKey is LIIHHUMNSSAWHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23FN2O/c1-4-17(3)16(21)20(11(2)12-8-9-12)15(19-17)13-6-5-7-14(18)10-13/h5-7,10-12,15,19H,4,8-9H2,1-3H3.
What are the key properties of 3-(1-cyclopropylethyl)-5-ethyl-2-(3-fluorophenyl)-5-methylimidazolidin-4-one?
3-(1-cyclopropylethyl)-5-ethyl-2-(3-fluorophenyl)-5-methylimidazolidin-4-one has a molecular weight of 290.38 g/mol, XLogP of 3.22, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-cyclopropylethyl)-5-ethyl-2-(3-fluorophenyl)-5-methylimidazolidin-4-one is sourced from PubChem (CID 83244740), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).