5-ethyl-2-(4-fluorophenyl)-3-hexan-3-ylimidazolidin-4-one

C17H25FN2O — CID 83253045

IUPAC5-ethyl-2-(4-fluorophenyl)-3-hexan-3-ylimidazolidin-4-one
SMILESCCCC(CC)N1C(=O)C(CC)NC1c1ccc(F)cc1
InChIInChI=1S/C17H25FN2O/c1-4-7-14(5-2)20-16(19-15(6-3)17(20)21)12-8-10-13(18)11-9-12/h8-11,14-16,19H,4-7H2,1-3H3
InChIKeyMGOCTLXQMRPBDN-UHFFFAOYSA-N
MW292.40 g/mol
LogP3.61
Rot. Bonds6

About 5-ethyl-2-(4-fluorophenyl)-3-hexan-3-ylimidazolidin-4-one

5-ethyl-2-(4-fluorophenyl)-3-hexan-3-ylimidazolidin-4-one (PubChem CID 83253045) has the molecular formula C17H25FN2O and a molecular weight of 292.40 g/mol. Its IUPAC name is 5-ethyl-2-(4-fluorophenyl)-3-hexan-3-ylimidazolidin-4-one.

Molecular Properties

Compound Name5-ethyl-2-(4-fluorophenyl)-3-hexan-3-ylimidazolidin-4-one
PubChem CID83253045
Molecular FormulaC17H25FN2O
Molecular Weight292.40 g/mol
Exact Mass292.20
IUPAC Name5-ethyl-2-(4-fluorophenyl)-3-hexan-3-ylimidazolidin-4-one
SMILESCCCC(CC)N1C(=O)C(CC)NC1c1ccc(F)cc1
InChIInChI=1S/C17H25FN2O/c1-4-7-14(5-2)20-16(19-15(6-3)17(20)21)12-8-10-13(18)11-9-12/h8-11,14-16,19H,4-7H2,1-3H3
InChIKeyMGOCTLXQMRPBDN-UHFFFAOYSA-N
XLogP3.61
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.40
LogP ≤ 53.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-butan-2-yl-5-butyl-2-(4-fluorophenyl)imidazolidin-4-one
CID 83237076
5-butyl-3-hexan-3-yl-2-thiophen-3-ylimidazolidin-4-one
CID 83251878
3-butan-2-yl-5-ethyl-2-(4-methylsulfanylphenyl)imidazolidin-4-one
CID 83238950
5-ethyl-3-hexan-2-yl-2-(4-methylphenyl)imidazolidin-4-one
CID 83252512
5-ethyl-3-pentan-2-yl-2-thiophen-3-ylimidazolidin-4-one
CID 83240083
3-cyclopentyl-5-ethyl-2-(4-fluorophenyl)imidazolidin-4-one
CID 83242494
5-ethyl-3-(5-methylhexan-2-yl)-2-phenylimidazolidin-4-one
CID 83263251
5-butyl-3-pentan-3-yl-2-thiophen-3-ylimidazolidin-4-one
CID 83243016
3-(2-cyclopropylethyl)-5-ethyl-2-(4-fluorophenyl)imidazolidin-4-one
CID 83258448
5-ethyl-3-hexan-2-yl-2-thiophen-3-ylimidazolidin-4-one
CID 83252367
3-ethyl-2-(4-fluorophenyl)-5-propylimidazolidin-4-one
CID 83239444
3-(1-ethoxypropan-2-yl)-5-ethyl-2-(4-methylphenyl)imidazolidin-4-one
CID 83244890

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-2-(4-fluorophenyl)-3-hexan-3-ylimidazolidin-4-one?
The IUPAC name of 5-ethyl-2-(4-fluorophenyl)-3-hexan-3-ylimidazolidin-4-one (CID 83253045) is 5-ethyl-2-(4-fluorophenyl)-3-hexan-3-ylimidazolidin-4-one.
What is the SMILES notation for 5-ethyl-2-(4-fluorophenyl)-3-hexan-3-ylimidazolidin-4-one?
The canonical SMILES for 5-ethyl-2-(4-fluorophenyl)-3-hexan-3-ylimidazolidin-4-one is CCCC(CC)N1C(=O)C(CC)NC1c1ccc(F)cc1.
What is the InChIKey of 5-ethyl-2-(4-fluorophenyl)-3-hexan-3-ylimidazolidin-4-one?
The InChIKey is MGOCTLXQMRPBDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25FN2O/c1-4-7-14(5-2)20-16(19-15(6-3)17(20)21)12-8-10-13(18)11-9-12/h8-11,14-16,19H,4-7H2,1-3H3.
What are the key properties of 5-ethyl-2-(4-fluorophenyl)-3-hexan-3-ylimidazolidin-4-one?
5-ethyl-2-(4-fluorophenyl)-3-hexan-3-ylimidazolidin-4-one has a molecular weight of 292.40 g/mol, XLogP of 3.61, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-2-(4-fluorophenyl)-3-hexan-3-ylimidazolidin-4-one is sourced from PubChem (CID 83253045), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).