5-ethyl-5-methyl-3-(3-methyl-2-propan-2-ylbutyl)-2-propan-2-ylimidazolidin-4-one

C17H34N2O — CID 102916100

IUPAC5-ethyl-5-methyl-3-(3-methyl-2-propan-2-ylbutyl)-2-propan-2-ylimidazolidin-4-one
SMILESCCC1(C)NC(C(C)C)N(CC(C(C)C)C(C)C)C1=O
InChIInChI=1S/C17H34N2O/c1-9-17(8)16(20)19(15(18-17)13(6)7)10-14(11(2)3)12(4)5/h11-15,18H,9-10H2,1-8H3
InChIKeyOGMOCZUAGROGQG-UHFFFAOYSA-N
MW282.47 g/mol
LogP3.50
Rot. Bonds6

About 5-ethyl-5-methyl-3-(3-methyl-2-propan-2-ylbutyl)-2-propan-2-ylimidazolidin-4-one

5-ethyl-5-methyl-3-(3-methyl-2-propan-2-ylbutyl)-2-propan-2-ylimidazolidin-4-one (PubChem CID 102916100) has the molecular formula C17H34N2O and a molecular weight of 282.47 g/mol. Its IUPAC name is 5-ethyl-5-methyl-3-(3-methyl-2-propan-2-ylbutyl)-2-propan-2-ylimidazolidin-4-one.

Molecular Properties

Compound Name5-ethyl-5-methyl-3-(3-methyl-2-propan-2-ylbutyl)-2-propan-2-ylimidazolidin-4-one
PubChem CID102916100
Molecular FormulaC17H34N2O
Molecular Weight282.47 g/mol
Exact Mass282.27
IUPAC Name5-ethyl-5-methyl-3-(3-methyl-2-propan-2-ylbutyl)-2-propan-2-ylimidazolidin-4-one
SMILESCCC1(C)NC(C(C)C)N(CC(C(C)C)C(C)C)C1=O
InChIInChI=1S/C17H34N2O/c1-9-17(8)16(20)19(15(18-17)13(6)7)10-14(11(2)3)12(4)5/h11-15,18H,9-10H2,1-8H3
InChIKeyOGMOCZUAGROGQG-UHFFFAOYSA-N
XLogP3.50
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.47
LogP ≤ 53.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-ethyl-5-methyl-3-(2-methylpropyl)-2-propan-2-ylimidazolidin-4-one
CID 83243083
5-ethyl-5-methyl-2-propan-2-yl-3-(2-pyrrolidin-1-ylethyl)imidazolidin-4-one
CID 83252393
5-ethyl-5-methyl-3-[(4-methylcyclohexyl)methyl]-2-propan-2-ylimidazolidin-4-one
CID 83254276
5-ethyl-5-methyl-3-(oxolan-2-ylmethyl)-2-propan-2-ylimidazolidin-4-one
CID 83250968
3-(1,4-dioxan-2-ylmethyl)-5-ethyl-5-methyl-2-propan-2-ylimidazolidin-4-one
CID 83256292
3-(1-cyclopropylethyl)-5-ethyl-5-methyl-2-propan-2-ylimidazolidin-4-one
CID 83244454
3-(2,3-dimethylbutyl)-5-ethyl-5-methyl-2-propylimidazolidin-4-one
CID 83259462
5-ethyl-3-[(4-ethylmorpholin-2-yl)methyl]-5-methyl-2-propan-2-ylimidazolidin-4-one
CID 114401683
3-[2-(dimethylamino)propyl]-2,5-diethyl-5-methylimidazolidin-4-one
CID 83250197
5-ethyl-5-methyl-2-(2-methylpropyl)-3-(2,3,3-trimethylbutyl)imidazolidin-4-one
CID 83260128
3-(1-cyclohexylethyl)-5-ethyl-5-methyl-2-propan-2-ylimidazolidin-4-one
CID 83255507
5-ethyl-2,5-dimethyl-3-(5-methylhexyl)imidazolidin-4-one
CID 83260814

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-5-methyl-3-(3-methyl-2-propan-2-ylbutyl)-2-propan-2-ylimidazolidin-4-one?
The IUPAC name of 5-ethyl-5-methyl-3-(3-methyl-2-propan-2-ylbutyl)-2-propan-2-ylimidazolidin-4-one (CID 102916100) is 5-ethyl-5-methyl-3-(3-methyl-2-propan-2-ylbutyl)-2-propan-2-ylimidazolidin-4-one.
What is the SMILES notation for 5-ethyl-5-methyl-3-(3-methyl-2-propan-2-ylbutyl)-2-propan-2-ylimidazolidin-4-one?
The canonical SMILES for 5-ethyl-5-methyl-3-(3-methyl-2-propan-2-ylbutyl)-2-propan-2-ylimidazolidin-4-one is CCC1(C)NC(C(C)C)N(CC(C(C)C)C(C)C)C1=O.
What is the InChIKey of 5-ethyl-5-methyl-3-(3-methyl-2-propan-2-ylbutyl)-2-propan-2-ylimidazolidin-4-one?
The InChIKey is OGMOCZUAGROGQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H34N2O/c1-9-17(8)16(20)19(15(18-17)13(6)7)10-14(11(2)3)12(4)5/h11-15,18H,9-10H2,1-8H3.
What are the key properties of 5-ethyl-5-methyl-3-(3-methyl-2-propan-2-ylbutyl)-2-propan-2-ylimidazolidin-4-one?
5-ethyl-5-methyl-3-(3-methyl-2-propan-2-ylbutyl)-2-propan-2-ylimidazolidin-4-one has a molecular weight of 282.47 g/mol, XLogP of 3.50, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-5-methyl-3-(3-methyl-2-propan-2-ylbutyl)-2-propan-2-ylimidazolidin-4-one is sourced from PubChem (CID 102916100), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).