3-(2,2-dimethylcyclopentyl)-2,5-dimethylimidazolidin-4-one

C12H22N2O — CID 83270588

IUPAC3-(2,2-dimethylcyclopentyl)-2,5-dimethylimidazolidin-4-one
SMILESCC1NC(C)N(C2CCCC2(C)C)C1=O
InChIInChI=1S/C12H22N2O/c1-8-11(15)14(9(2)13-8)10-6-5-7-12(10,3)4/h8-10,13H,5-7H2,1-4H3
InChIKeyYTGFYMLPGICYJB-UHFFFAOYSA-N
MW210.32 g/mol
LogP1.73
Rot. Bonds1

About 3-(2,2-dimethylcyclopentyl)-2,5-dimethylimidazolidin-4-one

3-(2,2-dimethylcyclopentyl)-2,5-dimethylimidazolidin-4-one (PubChem CID 83270588) has the molecular formula C12H22N2O and a molecular weight of 210.32 g/mol. Its IUPAC name is 3-(2,2-dimethylcyclopentyl)-2,5-dimethylimidazolidin-4-one.

Molecular Properties

Compound Name3-(2,2-dimethylcyclopentyl)-2,5-dimethylimidazolidin-4-one
PubChem CID83270588
Molecular FormulaC12H22N2O
Molecular Weight210.32 g/mol
Exact Mass210.17
IUPAC Name3-(2,2-dimethylcyclopentyl)-2,5-dimethylimidazolidin-4-one
SMILESCC1NC(C)N(C2CCCC2(C)C)C1=O
InChIInChI=1S/C12H22N2O/c1-8-11(15)14(9(2)13-8)10-6-5-7-12(10,3)4/h8-10,13H,5-7H2,1-4H3
InChIKeyYTGFYMLPGICYJB-UHFFFAOYSA-N
XLogP1.73
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.32
LogP ≤ 51.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-(2,2-dimethylcyclopentyl)-2,5-dimethylimidazolidin-4-one?
The IUPAC name of 3-(2,2-dimethylcyclopentyl)-2,5-dimethylimidazolidin-4-one (CID 83270588) is 3-(2,2-dimethylcyclopentyl)-2,5-dimethylimidazolidin-4-one.
What is the SMILES notation for 3-(2,2-dimethylcyclopentyl)-2,5-dimethylimidazolidin-4-one?
The canonical SMILES for 3-(2,2-dimethylcyclopentyl)-2,5-dimethylimidazolidin-4-one is CC1NC(C)N(C2CCCC2(C)C)C1=O.
What is the InChIKey of 3-(2,2-dimethylcyclopentyl)-2,5-dimethylimidazolidin-4-one?
The InChIKey is YTGFYMLPGICYJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2O/c1-8-11(15)14(9(2)13-8)10-6-5-7-12(10,3)4/h8-10,13H,5-7H2,1-4H3.
What are the key properties of 3-(2,2-dimethylcyclopentyl)-2,5-dimethylimidazolidin-4-one?
3-(2,2-dimethylcyclopentyl)-2,5-dimethylimidazolidin-4-one has a molecular weight of 210.32 g/mol, XLogP of 1.73, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,2-dimethylcyclopentyl)-2,5-dimethylimidazolidin-4-one is sourced from PubChem (CID 83270588), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).