3-(2,2-dimethylpropyl)-2,5-di(propan-2-yl)imidazolidin-4-one

C14H28N2O — CID 83256296

IUPAC3-(2,2-dimethylpropyl)-2,5-di(propan-2-yl)imidazolidin-4-one
SMILESCC(C)C1NC(C(C)C)N(CC(C)(C)C)C1=O
InChIInChI=1S/C14H28N2O/c1-9(2)11-13(17)16(8-14(5,6)7)12(15-11)10(3)4/h9-12,15H,8H2,1-7H3
InChIKeyCFJHEUXQHHIPRT-UHFFFAOYSA-N
MW240.39 g/mol
LogP2.47
Rot. Bonds3

About 3-(2,2-dimethylpropyl)-2,5-di(propan-2-yl)imidazolidin-4-one

3-(2,2-dimethylpropyl)-2,5-di(propan-2-yl)imidazolidin-4-one (PubChem CID 83256296) has the molecular formula C14H28N2O and a molecular weight of 240.39 g/mol. Its IUPAC name is 3-(2,2-dimethylpropyl)-2,5-di(propan-2-yl)imidazolidin-4-one.

Molecular Properties

Compound Name3-(2,2-dimethylpropyl)-2,5-di(propan-2-yl)imidazolidin-4-one
PubChem CID83256296
Molecular FormulaC14H28N2O
Molecular Weight240.39 g/mol
Exact Mass240.22
IUPAC Name3-(2,2-dimethylpropyl)-2,5-di(propan-2-yl)imidazolidin-4-one
SMILESCC(C)C1NC(C(C)C)N(CC(C)(C)C)C1=O
InChIInChI=1S/C14H28N2O/c1-9(2)11-13(17)16(8-14(5,6)7)12(15-11)10(3)4/h9-12,15H,8H2,1-7H3
InChIKeyCFJHEUXQHHIPRT-UHFFFAOYSA-N
XLogP2.47
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.39
LogP ≤ 52.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-(2,2-dimethylpropyl)-5-methyl-2-propan-2-ylimidazolidin-4-one
CID 83255750
3-butyl-2,5-di(propan-2-yl)imidazolidin-4-one
CID 83238523
3-(2,2-dimethylpropyl)-2-(5-methylthiophen-2-yl)-5-propan-2-ylimidazolidin-4-one
CID 83256875
5-butan-2-yl-3-(2-methoxy-2-methylpropyl)-2-propan-2-ylimidazolidin-4-one
CID 104767773
3-(5-methylhexyl)-2,5-di(propan-2-yl)imidazolidin-4-one
CID 83259998
2,5-di(propan-2-yl)-3-(2-pyrrolidin-1-ylpropyl)imidazolidin-4-one
CID 83270705
2-methyl-5-propan-2-yl-3-(2,2,3-trimethylbutyl)imidazolidin-4-one
CID 114102628
2-ethyl-5-propan-2-yl-3-(2,2,3-trimethylbutyl)imidazolidin-4-one
CID 114102621
3-[3-(dimethylamino)-2,2-dimethylpropyl]-2-methyl-5-propan-2-ylimidazolidin-4-one
CID 83236693
3-(2,2-dimethylpropyl)-2-propan-2-yl-1,3-diazaspiro[4.4]nonan-4-one
CID 83255752
5-butan-2-yl-3-(2,3-dimethylbutyl)-2-propan-2-ylimidazolidin-4-one
CID 83259293
3-pentan-2-yl-2,5-di(propan-2-yl)imidazolidin-4-one
CID 83238814

Frequently Asked Questions

What is the IUPAC name of 3-(2,2-dimethylpropyl)-2,5-di(propan-2-yl)imidazolidin-4-one?
The IUPAC name of 3-(2,2-dimethylpropyl)-2,5-di(propan-2-yl)imidazolidin-4-one (CID 83256296) is 3-(2,2-dimethylpropyl)-2,5-di(propan-2-yl)imidazolidin-4-one.
What is the SMILES notation for 3-(2,2-dimethylpropyl)-2,5-di(propan-2-yl)imidazolidin-4-one?
The canonical SMILES for 3-(2,2-dimethylpropyl)-2,5-di(propan-2-yl)imidazolidin-4-one is CC(C)C1NC(C(C)C)N(CC(C)(C)C)C1=O.
What is the InChIKey of 3-(2,2-dimethylpropyl)-2,5-di(propan-2-yl)imidazolidin-4-one?
The InChIKey is CFJHEUXQHHIPRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O/c1-9(2)11-13(17)16(8-14(5,6)7)12(15-11)10(3)4/h9-12,15H,8H2,1-7H3.
What are the key properties of 3-(2,2-dimethylpropyl)-2,5-di(propan-2-yl)imidazolidin-4-one?
3-(2,2-dimethylpropyl)-2,5-di(propan-2-yl)imidazolidin-4-one has a molecular weight of 240.39 g/mol, XLogP of 2.47, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,2-dimethylpropyl)-2,5-di(propan-2-yl)imidazolidin-4-one is sourced from PubChem (CID 83256296), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).