5-butan-2-yl-3-(2,2-dimethylcyclopentyl)-2-ethylimidazolidin-4-one

C16H30N2O — CID 83271073

IUPAC5-butan-2-yl-3-(2,2-dimethylcyclopentyl)-2-ethylimidazolidin-4-one
SMILESCCC(C)C1NC(CC)N(C2CCCC2(C)C)C1=O
InChIInChI=1S/C16H30N2O/c1-6-11(3)14-15(19)18(13(7-2)17-14)12-9-8-10-16(12,4)5/h11-14,17H,6-10H2,1-5H3
InChIKeyCFHCUXHQZHUJJV-UHFFFAOYSA-N
MW266.43 g/mol
LogP3.15
Rot. Bonds4

About 5-butan-2-yl-3-(2,2-dimethylcyclopentyl)-2-ethylimidazolidin-4-one

5-butan-2-yl-3-(2,2-dimethylcyclopentyl)-2-ethylimidazolidin-4-one (PubChem CID 83271073) has the molecular formula C16H30N2O and a molecular weight of 266.43 g/mol. Its IUPAC name is 5-butan-2-yl-3-(2,2-dimethylcyclopentyl)-2-ethylimidazolidin-4-one.

Molecular Properties

Compound Name5-butan-2-yl-3-(2,2-dimethylcyclopentyl)-2-ethylimidazolidin-4-one
PubChem CID83271073
Molecular FormulaC16H30N2O
Molecular Weight266.43 g/mol
Exact Mass266.24
IUPAC Name5-butan-2-yl-3-(2,2-dimethylcyclopentyl)-2-ethylimidazolidin-4-one
SMILESCCC(C)C1NC(CC)N(C2CCCC2(C)C)C1=O
InChIInChI=1S/C16H30N2O/c1-6-11(3)14-15(19)18(13(7-2)17-14)12-9-8-10-16(12,4)5/h11-14,17H,6-10H2,1-5H3
InChIKeyCFHCUXHQZHUJJV-UHFFFAOYSA-N
XLogP3.15
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.43
LogP ≤ 53.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-(2,2-dimethylcyclopentyl)-2-ethyl-5-propan-2-ylimidazolidin-4-one
CID 83270665
3-(2,2-dimethylcyclopentyl)-2-(2-methylpropyl)-5-propan-2-ylimidazolidin-4-one
CID 83270664
5-butan-2-yl-3-(3,3-dimethylcyclopentyl)-2-ethylimidazolidin-4-one
CID 114552428
5-butan-2-yl-3-(1,1-dioxothian-4-yl)-2-ethylimidazolidin-4-one
CID 83244291
5-butan-2-yl-2-ethyl-3-(3-ethyl-2-methylcyclopentyl)imidazolidin-4-one
CID 83259292
5-butan-2-yl-2-ethyl-3-[(1-methylcyclopropyl)methyl]imidazolidin-4-one
CID 114102642
5-butan-2-yl-3-cyclobutyl-2-(2-methylpropyl)imidazolidin-4-one
CID 83254319
5-butan-2-yl-2-ethyl-3-(2-methyloxolan-3-yl)imidazolidin-4-one
CID 83259587
1-(2,2-dimethylcyclopentyl)-3-ethyl-6-propan-2-ylpiperazine-2,5-dione
CID 79878827
3-(2,2-dimethylcyclopentyl)-2,5-dimethylimidazolidin-4-one
CID 83270588
5-butan-2-yl-3-(3-methylcyclopentyl)-2-(2-methylpropyl)imidazolidin-4-one
CID 114552346
3-cyclopropyl-1-(2,2-dimethylcyclopentyl)-6-ethylpiperazine-2,5-dione
CID 79878905

Frequently Asked Questions

What is the IUPAC name of 5-butan-2-yl-3-(2,2-dimethylcyclopentyl)-2-ethylimidazolidin-4-one?
The IUPAC name of 5-butan-2-yl-3-(2,2-dimethylcyclopentyl)-2-ethylimidazolidin-4-one (CID 83271073) is 5-butan-2-yl-3-(2,2-dimethylcyclopentyl)-2-ethylimidazolidin-4-one.
What is the SMILES notation for 5-butan-2-yl-3-(2,2-dimethylcyclopentyl)-2-ethylimidazolidin-4-one?
The canonical SMILES for 5-butan-2-yl-3-(2,2-dimethylcyclopentyl)-2-ethylimidazolidin-4-one is CCC(C)C1NC(CC)N(C2CCCC2(C)C)C1=O.
What is the InChIKey of 5-butan-2-yl-3-(2,2-dimethylcyclopentyl)-2-ethylimidazolidin-4-one?
The InChIKey is CFHCUXHQZHUJJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30N2O/c1-6-11(3)14-15(19)18(13(7-2)17-14)12-9-8-10-16(12,4)5/h11-14,17H,6-10H2,1-5H3.
What are the key properties of 5-butan-2-yl-3-(2,2-dimethylcyclopentyl)-2-ethylimidazolidin-4-one?
5-butan-2-yl-3-(2,2-dimethylcyclopentyl)-2-ethylimidazolidin-4-one has a molecular weight of 266.43 g/mol, XLogP of 3.15, 4 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-(2,2-dimethylcyclopentyl)-2-ethylimidazolidin-4-one is sourced from PubChem (CID 83271073), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).