5-butan-2-yl-3-(1-ethoxypropan-2-yl)-2-(2-methylpropyl)imidazolidin-4-one

C16H32N2O2 — CID 83245364

IUPAC5-butan-2-yl-3-(1-ethoxypropan-2-yl)-2-(2-methylpropyl)imidazolidin-4-one
SMILESCCOCC(C)N1C(=O)C(C(C)CC)NC1CC(C)C
InChIInChI=1S/C16H32N2O2/c1-7-12(5)15-16(19)18(13(6)10-20-8-2)14(17-15)9-11(3)4/h11-15,17H,7-10H2,1-6H3
InChIKeyCWIUYOYIRMZXOU-UHFFFAOYSA-N
MW284.44 g/mol
LogP2.63
Rot. Bonds8

About 5-butan-2-yl-3-(1-ethoxypropan-2-yl)-2-(2-methylpropyl)imidazolidin-4-one

5-butan-2-yl-3-(1-ethoxypropan-2-yl)-2-(2-methylpropyl)imidazolidin-4-one (PubChem CID 83245364) has the molecular formula C16H32N2O2 and a molecular weight of 284.44 g/mol. Its IUPAC name is 5-butan-2-yl-3-(1-ethoxypropan-2-yl)-2-(2-methylpropyl)imidazolidin-4-one.

Molecular Properties

Compound Name5-butan-2-yl-3-(1-ethoxypropan-2-yl)-2-(2-methylpropyl)imidazolidin-4-one
PubChem CID83245364
Molecular FormulaC16H32N2O2
Molecular Weight284.44 g/mol
Exact Mass284.25
IUPAC Name5-butan-2-yl-3-(1-ethoxypropan-2-yl)-2-(2-methylpropyl)imidazolidin-4-one
SMILESCCOCC(C)N1C(=O)C(C(C)CC)NC1CC(C)C
InChIInChI=1S/C16H32N2O2/c1-7-12(5)15-16(19)18(13(6)10-20-8-2)14(17-15)9-11(3)4/h11-15,17H,7-10H2,1-6H3
InChIKeyCWIUYOYIRMZXOU-UHFFFAOYSA-N
XLogP2.63
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.44
LogP ≤ 52.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-butan-2-yl-3-(1-ethoxypropan-2-yl)-2-propylimidazolidin-4-one
CID 83247716
3-(1-ethoxypropan-2-yl)-5-methyl-2-(2-methylpropyl)imidazolidin-4-one
CID 83246924
5-butan-2-yl-3-methyl-2-(2-methylpropyl)imidazolidin-4-one
CID 83260681
3-(1-ethoxypropan-2-yl)-2-methyl-5-(2-methylpropyl)imidazolidin-4-one
CID 83246403
2-(2-methylpropyl)-3-pentan-2-yl-5-propan-2-ylimidazolidin-4-one
CID 83238813
5-butan-2-yl-3-(5-methylhexan-2-yl)-2-propylimidazolidin-4-one
CID 83263112
5-butan-2-yl-3-(3-methylbutyl)-2-(2-methylpropyl)imidazolidin-4-one
CID 83237061
5-butan-2-yl-3-[1-(dimethylamino)propan-2-yl]-2-ethylimidazolidin-4-one
CID 83260616
5-butan-2-yl-2-(2-methylpropyl)-3-pentylimidazolidin-4-one
CID 83250722
5-butan-2-yl-3-cyclobutyl-2-(2-methylpropyl)imidazolidin-4-one
CID 83254319
5-butan-2-yl-2-ethyl-3-octan-2-ylimidazolidin-4-one
CID 83248188
5-butan-2-yl-3-pentan-3-yl-2-propylimidazolidin-4-one
CID 83241971

Frequently Asked Questions

What is the IUPAC name of 5-butan-2-yl-3-(1-ethoxypropan-2-yl)-2-(2-methylpropyl)imidazolidin-4-one?
The IUPAC name of 5-butan-2-yl-3-(1-ethoxypropan-2-yl)-2-(2-methylpropyl)imidazolidin-4-one (CID 83245364) is 5-butan-2-yl-3-(1-ethoxypropan-2-yl)-2-(2-methylpropyl)imidazolidin-4-one.
What is the SMILES notation for 5-butan-2-yl-3-(1-ethoxypropan-2-yl)-2-(2-methylpropyl)imidazolidin-4-one?
The canonical SMILES for 5-butan-2-yl-3-(1-ethoxypropan-2-yl)-2-(2-methylpropyl)imidazolidin-4-one is CCOCC(C)N1C(=O)C(C(C)CC)NC1CC(C)C.
What is the InChIKey of 5-butan-2-yl-3-(1-ethoxypropan-2-yl)-2-(2-methylpropyl)imidazolidin-4-one?
The InChIKey is CWIUYOYIRMZXOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32N2O2/c1-7-12(5)15-16(19)18(13(6)10-20-8-2)14(17-15)9-11(3)4/h11-15,17H,7-10H2,1-6H3.
What are the key properties of 5-butan-2-yl-3-(1-ethoxypropan-2-yl)-2-(2-methylpropyl)imidazolidin-4-one?
5-butan-2-yl-3-(1-ethoxypropan-2-yl)-2-(2-methylpropyl)imidazolidin-4-one has a molecular weight of 284.44 g/mol, XLogP of 2.63, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-butan-2-yl-3-(1-ethoxypropan-2-yl)-2-(2-methylpropyl)imidazolidin-4-one is sourced from PubChem (CID 83245364), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).