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

C17H32N2O — CID 114552346

IUPAC5-butan-2-yl-3-(3-methylcyclopentyl)-2-(2-methylpropyl)imidazolidin-4-one
SMILESCCC(C)C1NC(CC(C)C)N(C2CCC(C)C2)C1=O
InChIInChI=1S/C17H32N2O/c1-6-13(5)16-17(20)19(14-8-7-12(4)10-14)15(18-16)9-11(2)3/h11-16,18H,6-10H2,1-5H3
InChIKeyMUPMPHHRGHUEBD-UHFFFAOYSA-N
MW280.46 g/mol
LogP3.39
Rot. Bonds5

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

5-butan-2-yl-3-(3-methylcyclopentyl)-2-(2-methylpropyl)imidazolidin-4-one (PubChem CID 114552346) has the molecular formula C17H32N2O and a molecular weight of 280.46 g/mol. Its IUPAC name is 5-butan-2-yl-3-(3-methylcyclopentyl)-2-(2-methylpropyl)imidazolidin-4-one.

Molecular Properties

Compound Name5-butan-2-yl-3-(3-methylcyclopentyl)-2-(2-methylpropyl)imidazolidin-4-one
PubChem CID114552346
Molecular FormulaC17H32N2O
Molecular Weight280.46 g/mol
Exact Mass280.25
IUPAC Name5-butan-2-yl-3-(3-methylcyclopentyl)-2-(2-methylpropyl)imidazolidin-4-one
SMILESCCC(C)C1NC(CC(C)C)N(C2CCC(C)C2)C1=O
InChIInChI=1S/C17H32N2O/c1-6-13(5)16-17(20)19(14-8-7-12(4)10-14)15(18-16)9-11(2)3/h11-16,18H,6-10H2,1-5H3
InChIKeyMUPMPHHRGHUEBD-UHFFFAOYSA-N
XLogP3.39
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.46
LogP ≤ 53.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-butan-2-yl-3-cyclobutyl-2-(2-methylpropyl)imidazolidin-4-one
CID 83254319
3-(3-methylcyclobutyl)-2-(2-methylpropyl)-5-propan-2-ylimidazolidin-4-one
CID 113467617
3-(3,4-dimethylcyclohexyl)-2-(2-methylpropyl)-5-propylimidazolidin-4-one
CID 83263293
5-butan-2-yl-3-(3,4-dimethylcyclohexyl)-2-methylimidazolidin-4-one
CID 83263151
5-butan-2-yl-3-(1,1-dioxothian-4-yl)-2-ethylimidazolidin-4-one
CID 83244291
5-butan-2-yl-3-methyl-2-(2-methylpropyl)imidazolidin-4-one
CID 83260681
5-methyl-2-(2-methylpropyl)-3-(4-propylcyclohexyl)imidazolidin-4-one
CID 83249194
5-butan-2-yl-2-(2-methylpropyl)-3-pentylimidazolidin-4-one
CID 83250722
3-(1,1-dioxothian-4-yl)-5-methyl-2-(2-methylpropyl)imidazolidin-4-one
CID 83243465
5-butan-2-yl-3-(3-methylbutyl)-2-(2-methylpropyl)imidazolidin-4-one
CID 83237061
5-butan-2-yl-3-(3,3-dimethylcyclopentyl)-2-ethylimidazolidin-4-one
CID 114552428
5-ethyl-3-(3-methylcyclopentyl)-2-propylimidazolidin-4-one
CID 114552240

Frequently Asked Questions

What is the IUPAC name of 5-butan-2-yl-3-(3-methylcyclopentyl)-2-(2-methylpropyl)imidazolidin-4-one?
The IUPAC name of 5-butan-2-yl-3-(3-methylcyclopentyl)-2-(2-methylpropyl)imidazolidin-4-one (CID 114552346) is 5-butan-2-yl-3-(3-methylcyclopentyl)-2-(2-methylpropyl)imidazolidin-4-one.
What is the SMILES notation for 5-butan-2-yl-3-(3-methylcyclopentyl)-2-(2-methylpropyl)imidazolidin-4-one?
The canonical SMILES for 5-butan-2-yl-3-(3-methylcyclopentyl)-2-(2-methylpropyl)imidazolidin-4-one is CCC(C)C1NC(CC(C)C)N(C2CCC(C)C2)C1=O.
What is the InChIKey of 5-butan-2-yl-3-(3-methylcyclopentyl)-2-(2-methylpropyl)imidazolidin-4-one?
The InChIKey is MUPMPHHRGHUEBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H32N2O/c1-6-13(5)16-17(20)19(14-8-7-12(4)10-14)15(18-16)9-11(2)3/h11-16,18H,6-10H2,1-5H3.
What are the key properties of 5-butan-2-yl-3-(3-methylcyclopentyl)-2-(2-methylpropyl)imidazolidin-4-one?
5-butan-2-yl-3-(3-methylcyclopentyl)-2-(2-methylpropyl)imidazolidin-4-one has a molecular weight of 280.46 g/mol, XLogP of 3.39, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-butan-2-yl-3-(3-methylcyclopentyl)-2-(2-methylpropyl)imidazolidin-4-one is sourced from PubChem (CID 114552346), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).