5-ethyl-3-(2-fluoroethyl)-5-methylimidazolidin-4-one

C8H15FN2O — CID 130504764

IUPAC5-ethyl-3-(2-fluoroethyl)-5-methylimidazolidin-4-one
SMILESCCC1(C)NCN(CCF)C1=O
InChIInChI=1S/C8H15FN2O/c1-3-8(2)7(12)11(5-4-9)6-10-8/h10H,3-6H2,1-2H3
InChIKeyRCOVONHXSBTJNR-UHFFFAOYSA-N
MW174.22 g/mol
LogP0.51
Rot. Bonds3

About 5-ethyl-3-(2-fluoroethyl)-5-methylimidazolidin-4-one

5-ethyl-3-(2-fluoroethyl)-5-methylimidazolidin-4-one (PubChem CID 130504764) has the molecular formula C8H15FN2O and a molecular weight of 174.22 g/mol. Its IUPAC name is 5-ethyl-3-(2-fluoroethyl)-5-methylimidazolidin-4-one.

Molecular Properties

Compound Name5-ethyl-3-(2-fluoroethyl)-5-methylimidazolidin-4-one
PubChem CID130504764
Molecular FormulaC8H15FN2O
Molecular Weight174.22 g/mol
Exact Mass174.12
IUPAC Name5-ethyl-3-(2-fluoroethyl)-5-methylimidazolidin-4-one
SMILESCCC1(C)NCN(CCF)C1=O
InChIInChI=1S/C8H15FN2O/c1-3-8(2)7(12)11(5-4-9)6-10-8/h10H,3-6H2,1-2H3
InChIKeyRCOVONHXSBTJNR-UHFFFAOYSA-N
XLogP0.51
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.22
LogP ≤ 50.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-ethyl-3-(2-fluoroethyl)-5-methylimidazolidin-4-one?
The IUPAC name of 5-ethyl-3-(2-fluoroethyl)-5-methylimidazolidin-4-one (CID 130504764) is 5-ethyl-3-(2-fluoroethyl)-5-methylimidazolidin-4-one.
What is the SMILES notation for 5-ethyl-3-(2-fluoroethyl)-5-methylimidazolidin-4-one?
The canonical SMILES for 5-ethyl-3-(2-fluoroethyl)-5-methylimidazolidin-4-one is CCC1(C)NCN(CCF)C1=O.
What is the InChIKey of 5-ethyl-3-(2-fluoroethyl)-5-methylimidazolidin-4-one?
The InChIKey is RCOVONHXSBTJNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15FN2O/c1-3-8(2)7(12)11(5-4-9)6-10-8/h10H,3-6H2,1-2H3.
What are the key properties of 5-ethyl-3-(2-fluoroethyl)-5-methylimidazolidin-4-one?
5-ethyl-3-(2-fluoroethyl)-5-methylimidazolidin-4-one has a molecular weight of 174.22 g/mol, XLogP of 0.51, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-3-(2-fluoroethyl)-5-methylimidazolidin-4-one is sourced from PubChem (CID 130504764), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).