2-ethyl-3-(2-methyloxolan-3-yl)-5-phenylimidazolidin-4-one

C16H22N2O2 — CID 83260745

IUPAC2-ethyl-3-(2-methyloxolan-3-yl)-5-phenylimidazolidin-4-one
SMILESCCC1NC(c2ccccc2)C(=O)N1C1CCOC1C
InChIInChI=1S/C16H22N2O2/c1-3-14-17-15(12-7-5-4-6-8-12)16(19)18(14)13-9-10-20-11(13)2/h4-8,11,13-15,17H,3,9-10H2,1-2H3
InChIKeyJYGXOIQYVKWVMT-UHFFFAOYSA-N
MW274.36 g/mol
LogP2.07
Rot. Bonds3

About 2-ethyl-3-(2-methyloxolan-3-yl)-5-phenylimidazolidin-4-one

2-ethyl-3-(2-methyloxolan-3-yl)-5-phenylimidazolidin-4-one (PubChem CID 83260745) has the molecular formula C16H22N2O2 and a molecular weight of 274.36 g/mol. Its IUPAC name is 2-ethyl-3-(2-methyloxolan-3-yl)-5-phenylimidazolidin-4-one.

Molecular Properties

Compound Name2-ethyl-3-(2-methyloxolan-3-yl)-5-phenylimidazolidin-4-one
PubChem CID83260745
Molecular FormulaC16H22N2O2
Molecular Weight274.36 g/mol
Exact Mass274.17
IUPAC Name2-ethyl-3-(2-methyloxolan-3-yl)-5-phenylimidazolidin-4-one
SMILESCCC1NC(c2ccccc2)C(=O)N1C1CCOC1C
InChIInChI=1S/C16H22N2O2/c1-3-14-17-15(12-7-5-4-6-8-12)16(19)18(14)13-9-10-20-11(13)2/h4-8,11,13-15,17H,3,9-10H2,1-2H3
InChIKeyJYGXOIQYVKWVMT-UHFFFAOYSA-N
XLogP2.07
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.36
LogP ≤ 52.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-ethyl-3-(2-methyloxolan-3-yl)-5-phenylimidazolidin-4-one?
The IUPAC name of 2-ethyl-3-(2-methyloxolan-3-yl)-5-phenylimidazolidin-4-one (CID 83260745) is 2-ethyl-3-(2-methyloxolan-3-yl)-5-phenylimidazolidin-4-one.
What is the SMILES notation for 2-ethyl-3-(2-methyloxolan-3-yl)-5-phenylimidazolidin-4-one?
The canonical SMILES for 2-ethyl-3-(2-methyloxolan-3-yl)-5-phenylimidazolidin-4-one is CCC1NC(c2ccccc2)C(=O)N1C1CCOC1C.
What is the InChIKey of 2-ethyl-3-(2-methyloxolan-3-yl)-5-phenylimidazolidin-4-one?
The InChIKey is JYGXOIQYVKWVMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2O2/c1-3-14-17-15(12-7-5-4-6-8-12)16(19)18(14)13-9-10-20-11(13)2/h4-8,11,13-15,17H,3,9-10H2,1-2H3.
What are the key properties of 2-ethyl-3-(2-methyloxolan-3-yl)-5-phenylimidazolidin-4-one?
2-ethyl-3-(2-methyloxolan-3-yl)-5-phenylimidazolidin-4-one has a molecular weight of 274.36 g/mol, XLogP of 2.07, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-3-(2-methyloxolan-3-yl)-5-phenylimidazolidin-4-one is sourced from PubChem (CID 83260745), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).