3-(2,2-dimethylcyclopropyl)-5-methyl-2-propan-2-ylimidazolidin-4-one

C12H22N2O — CID 83247388

IUPAC3-(2,2-dimethylcyclopropyl)-5-methyl-2-propan-2-ylimidazolidin-4-one
SMILESCC1NC(C(C)C)N(C2CC2(C)C)C1=O
InChIInChI=1S/C12H22N2O/c1-7(2)10-13-8(3)11(15)14(10)9-6-12(9,4)5/h7-10,13H,6H2,1-5H3
InChIKeyVHBBLLZGZVLYOV-UHFFFAOYSA-N
MW210.32 g/mol
LogP1.59
Rot. Bonds2

About 3-(2,2-dimethylcyclopropyl)-5-methyl-2-propan-2-ylimidazolidin-4-one

3-(2,2-dimethylcyclopropyl)-5-methyl-2-propan-2-ylimidazolidin-4-one (PubChem CID 83247388) has the molecular formula C12H22N2O and a molecular weight of 210.32 g/mol. Its IUPAC name is 3-(2,2-dimethylcyclopropyl)-5-methyl-2-propan-2-ylimidazolidin-4-one.

Molecular Properties

Compound Name3-(2,2-dimethylcyclopropyl)-5-methyl-2-propan-2-ylimidazolidin-4-one
PubChem CID83247388
Molecular FormulaC12H22N2O
Molecular Weight210.32 g/mol
Exact Mass210.17
IUPAC Name3-(2,2-dimethylcyclopropyl)-5-methyl-2-propan-2-ylimidazolidin-4-one
SMILESCC1NC(C(C)C)N(C2CC2(C)C)C1=O
InChIInChI=1S/C12H22N2O/c1-7(2)10-13-8(3)11(15)14(10)9-6-12(9,4)5/h7-10,13H,6H2,1-5H3
InChIKeyVHBBLLZGZVLYOV-UHFFFAOYSA-N
XLogP1.59
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.32
LogP ≤ 51.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-benzyl-3-(2,2-dimethylcyclopropyl)-2-propan-2-ylimidazolidin-4-one
CID 83247652
3-(2,2-dimethylcyclopropyl)-2-(4-fluorophenyl)-5-methylimidazolidin-4-one
CID 83247124
5-methyl-2-propan-2-yl-3-propylimidazolidin-4-one
CID 83243212
3-(1-cyclohexylethyl)-5-methyl-2-propan-2-ylimidazolidin-4-one
CID 83255331
3-(2,2-dimethylpropyl)-5-methyl-2-propan-2-ylimidazolidin-4-one
CID 83255750
3-(2,2-dimethylcyclopropyl)-5-(2-methylpropyl)-2-propylimidazolidin-4-one
CID 83246068
3-(2,2-dimethylcyclopentyl)-2,5-dimethylimidazolidin-4-one
CID 83270588
3-(1-cyclopropylbutan-2-yl)-5-methyl-2-propan-2-ylimidazolidin-4-one
CID 83263558
5-methyl-3-[(2-methylcyclohexyl)methyl]-2-propan-2-ylimidazolidin-4-one
CID 83256159
5-ethyl-3-(2-methylcyclopropyl)-2-propan-2-ylimidazolidin-4-one
CID 83254497
5-methyl-3-[1-(oxolan-2-yl)ethyl]-2-propan-2-ylimidazolidin-4-one
CID 83243781
1-(2,2-dimethylcyclohexyl)-3-methyl-6-propan-2-ylpiperazine-2,5-dione
CID 79878671

Frequently Asked Questions

What is the IUPAC name of 3-(2,2-dimethylcyclopropyl)-5-methyl-2-propan-2-ylimidazolidin-4-one?
The IUPAC name of 3-(2,2-dimethylcyclopropyl)-5-methyl-2-propan-2-ylimidazolidin-4-one (CID 83247388) is 3-(2,2-dimethylcyclopropyl)-5-methyl-2-propan-2-ylimidazolidin-4-one.
What is the SMILES notation for 3-(2,2-dimethylcyclopropyl)-5-methyl-2-propan-2-ylimidazolidin-4-one?
The canonical SMILES for 3-(2,2-dimethylcyclopropyl)-5-methyl-2-propan-2-ylimidazolidin-4-one is CC1NC(C(C)C)N(C2CC2(C)C)C1=O.
What is the InChIKey of 3-(2,2-dimethylcyclopropyl)-5-methyl-2-propan-2-ylimidazolidin-4-one?
The InChIKey is VHBBLLZGZVLYOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N2O/c1-7(2)10-13-8(3)11(15)14(10)9-6-12(9,4)5/h7-10,13H,6H2,1-5H3.
What are the key properties of 3-(2,2-dimethylcyclopropyl)-5-methyl-2-propan-2-ylimidazolidin-4-one?
3-(2,2-dimethylcyclopropyl)-5-methyl-2-propan-2-ylimidazolidin-4-one has a molecular weight of 210.32 g/mol, XLogP of 1.59, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,2-dimethylcyclopropyl)-5-methyl-2-propan-2-ylimidazolidin-4-one is sourced from PubChem (CID 83247388), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).