5-butyl-2-ethyl-3-(3-ethylcyclohexyl)imidazolidin-4-one

C17H32N2O — CID 83258233

IUPAC5-butyl-2-ethyl-3-(3-ethylcyclohexyl)imidazolidin-4-one
SMILESCCCCC1NC(CC)N(C2CCCC(CC)C2)C1=O
InChIInChI=1S/C17H32N2O/c1-4-7-11-15-17(20)19(16(6-3)18-15)14-10-8-9-13(5-2)12-14/h13-16,18H,4-12H2,1-3H3
InChIKeyRVNRMFYMIFQXRZ-UHFFFAOYSA-N
MW280.46 g/mol
LogP3.68
Rot. Bonds6

About 5-butyl-2-ethyl-3-(3-ethylcyclohexyl)imidazolidin-4-one

5-butyl-2-ethyl-3-(3-ethylcyclohexyl)imidazolidin-4-one (PubChem CID 83258233) has the molecular formula C17H32N2O and a molecular weight of 280.46 g/mol. Its IUPAC name is 5-butyl-2-ethyl-3-(3-ethylcyclohexyl)imidazolidin-4-one.

Molecular Properties

Compound Name5-butyl-2-ethyl-3-(3-ethylcyclohexyl)imidazolidin-4-one
PubChem CID83258233
Molecular FormulaC17H32N2O
Molecular Weight280.46 g/mol
Exact Mass280.25
IUPAC Name5-butyl-2-ethyl-3-(3-ethylcyclohexyl)imidazolidin-4-one
SMILESCCCCC1NC(CC)N(C2CCCC(CC)C2)C1=O
InChIInChI=1S/C17H32N2O/c1-4-7-11-15-17(20)19(16(6-3)18-15)14-10-8-9-13(5-2)12-14/h13-16,18H,4-12H2,1-3H3
InChIKeyRVNRMFYMIFQXRZ-UHFFFAOYSA-N
XLogP3.68
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.46
LogP ≤ 53.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-butyl-3-(3-ethylcyclohexyl)-2-propylimidazolidin-4-one
CID 83266721
5-butyl-2-ethyl-3-(4-methylcyclohexyl)imidazolidin-4-one
CID 83238921
5-butyl-2-ethyl-3-(4-hydroxycyclohexyl)imidazolidin-4-one
CID 83239492
5-butyl-3-cyclooctyl-2-propylimidazolidin-4-one
CID 83238137
3-cyclooctyl-2-ethyl-5-propylimidazolidin-4-one
CID 83238796
2,5-diethyl-3-(9-methyl-9-azabicyclo[3.3.1]nonan-3-yl)imidazolidin-4-one
CID 83263928
3-(4-ethylcyclohexyl)-2,5-dipropylimidazolidin-4-one
CID 83255938
3-(3,5-dimethylcyclohexyl)-2-ethyl-5-propylimidazolidin-4-one
CID 83259395
2-ethyl-3-(oxan-4-yl)-5-propylimidazolidin-4-one
CID 83256508
5-butyl-2-cyclopentyl-3-(3-methylcyclopentyl)imidazolidin-4-one
CID 114552252
3-(3,4-dimethylcyclohexyl)-2,5-diethylimidazolidin-4-one
CID 83263458
5-butyl-3-cycloheptyl-2-propan-2-ylimidazolidin-4-one
CID 83244477

Frequently Asked Questions

What is the IUPAC name of 5-butyl-2-ethyl-3-(3-ethylcyclohexyl)imidazolidin-4-one?
The IUPAC name of 5-butyl-2-ethyl-3-(3-ethylcyclohexyl)imidazolidin-4-one (CID 83258233) is 5-butyl-2-ethyl-3-(3-ethylcyclohexyl)imidazolidin-4-one.
What is the SMILES notation for 5-butyl-2-ethyl-3-(3-ethylcyclohexyl)imidazolidin-4-one?
The canonical SMILES for 5-butyl-2-ethyl-3-(3-ethylcyclohexyl)imidazolidin-4-one is CCCCC1NC(CC)N(C2CCCC(CC)C2)C1=O.
What is the InChIKey of 5-butyl-2-ethyl-3-(3-ethylcyclohexyl)imidazolidin-4-one?
The InChIKey is RVNRMFYMIFQXRZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H32N2O/c1-4-7-11-15-17(20)19(16(6-3)18-15)14-10-8-9-13(5-2)12-14/h13-16,18H,4-12H2,1-3H3.
What are the key properties of 5-butyl-2-ethyl-3-(3-ethylcyclohexyl)imidazolidin-4-one?
5-butyl-2-ethyl-3-(3-ethylcyclohexyl)imidazolidin-4-one has a molecular weight of 280.46 g/mol, XLogP of 3.68, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-butyl-2-ethyl-3-(3-ethylcyclohexyl)imidazolidin-4-one is sourced from PubChem (CID 83258233), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).