2-ethyl-5-(2-methylpropyl)-3-(oxan-3-ylmethyl)imidazolidin-4-one

C15H28N2O2 — CID 83250078

IUPAC2-ethyl-5-(2-methylpropyl)-3-(oxan-3-ylmethyl)imidazolidin-4-one
SMILESCCC1NC(CC(C)C)C(=O)N1CC1CCCOC1
InChIInChI=1S/C15H28N2O2/c1-4-14-16-13(8-11(2)3)15(18)17(14)9-12-6-5-7-19-10-12/h11-14,16H,4-10H2,1-3H3
InChIKeyCKFQDOKSAZPTLU-UHFFFAOYSA-N
MW268.40 g/mol
LogP2.00
Rot. Bonds5

About 2-ethyl-5-(2-methylpropyl)-3-(oxan-3-ylmethyl)imidazolidin-4-one

2-ethyl-5-(2-methylpropyl)-3-(oxan-3-ylmethyl)imidazolidin-4-one (PubChem CID 83250078) has the molecular formula C15H28N2O2 and a molecular weight of 268.40 g/mol. Its IUPAC name is 2-ethyl-5-(2-methylpropyl)-3-(oxan-3-ylmethyl)imidazolidin-4-one.

Molecular Properties

Compound Name2-ethyl-5-(2-methylpropyl)-3-(oxan-3-ylmethyl)imidazolidin-4-one
PubChem CID83250078
Molecular FormulaC15H28N2O2
Molecular Weight268.40 g/mol
Exact Mass268.22
IUPAC Name2-ethyl-5-(2-methylpropyl)-3-(oxan-3-ylmethyl)imidazolidin-4-one
SMILESCCC1NC(CC(C)C)C(=O)N1CC1CCCOC1
InChIInChI=1S/C15H28N2O2/c1-4-14-16-13(8-11(2)3)15(18)17(14)9-12-6-5-7-19-10-12/h11-14,16H,4-10H2,1-3H3
InChIKeyCKFQDOKSAZPTLU-UHFFFAOYSA-N
XLogP2.00
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.40
LogP ≤ 52.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2-methylpropyl)-3-(oxan-3-ylmethyl)-5-propylimidazolidin-4-one
CID 83250292
2-ethyl-5-(2-methylpropyl)-3-(oxan-2-ylmethyl)imidazolidin-4-one
CID 83255692
3-(cyclohexylmethyl)-5-(2-methylpropyl)-2-propylimidazolidin-4-one
CID 83244505
3-ethyl-1-(oxan-3-ylmethyl)-6-propan-2-ylpiperazine-2,5-dione
CID 64967664
3-(2,2-dicyclopropylethyl)-2-ethyl-5-(2-methylpropyl)imidazolidin-4-one
CID 83259329
5-butan-2-yl-2-methyl-3-(oxan-3-ylmethyl)imidazolidin-4-one
CID 83250080
2-ethyl-5-(2-methylpropyl)-3-(oxan-4-yl)imidazolidin-4-one
CID 83255946
2-ethyl-3-[2-(4-methylcyclohexyl)ethyl]-5-(2-methylpropyl)imidazolidin-4-one
CID 83262817
3-(cyclobutylmethyl)-2-ethyl-5-propan-2-ylimidazolidin-4-one
CID 83243656
3-[2-(dimethylamino)ethyl]-2-ethyl-5-(2-methylpropyl)imidazolidin-4-one
CID 83251512
2-ethyl-5-(2-methylpropyl)-3-octylimidazolidin-4-one
CID 83260834
2-(2-methylpropyl)-3-(oxolan-3-ylmethyl)imidazolidin-4-one
CID 83255125

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-5-(2-methylpropyl)-3-(oxan-3-ylmethyl)imidazolidin-4-one?
The IUPAC name of 2-ethyl-5-(2-methylpropyl)-3-(oxan-3-ylmethyl)imidazolidin-4-one (CID 83250078) is 2-ethyl-5-(2-methylpropyl)-3-(oxan-3-ylmethyl)imidazolidin-4-one.
What is the SMILES notation for 2-ethyl-5-(2-methylpropyl)-3-(oxan-3-ylmethyl)imidazolidin-4-one?
The canonical SMILES for 2-ethyl-5-(2-methylpropyl)-3-(oxan-3-ylmethyl)imidazolidin-4-one is CCC1NC(CC(C)C)C(=O)N1CC1CCCOC1.
What is the InChIKey of 2-ethyl-5-(2-methylpropyl)-3-(oxan-3-ylmethyl)imidazolidin-4-one?
The InChIKey is CKFQDOKSAZPTLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O2/c1-4-14-16-13(8-11(2)3)15(18)17(14)9-12-6-5-7-19-10-12/h11-14,16H,4-10H2,1-3H3.
What are the key properties of 2-ethyl-5-(2-methylpropyl)-3-(oxan-3-ylmethyl)imidazolidin-4-one?
2-ethyl-5-(2-methylpropyl)-3-(oxan-3-ylmethyl)imidazolidin-4-one has a molecular weight of 268.40 g/mol, XLogP of 2.00, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-5-(2-methylpropyl)-3-(oxan-3-ylmethyl)imidazolidin-4-one is sourced from PubChem (CID 83250078), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).