3-(2,2,3,3-tetramethylbutyl)imidazolidin-4-one

C11H22N2O — CID 130666327

IUPAC3-(2,2,3,3-tetramethylbutyl)imidazolidin-4-one
SMILESCC(C)(C)C(C)(C)CN1CNCC1=O
InChIInChI=1S/C11H22N2O/c1-10(2,3)11(4,5)7-13-8-12-6-9(13)14/h12H,6-8H2,1-5H3
InChIKeyJJSYEQNEYMEINN-UHFFFAOYSA-N
MW198.31 g/mol
LogP1.45
Rot. Bonds2

About 3-(2,2,3,3-tetramethylbutyl)imidazolidin-4-one

3-(2,2,3,3-tetramethylbutyl)imidazolidin-4-one (PubChem CID 130666327) has the molecular formula C11H22N2O and a molecular weight of 198.31 g/mol. Its IUPAC name is 3-(2,2,3,3-tetramethylbutyl)imidazolidin-4-one.

Molecular Properties

Compound Name3-(2,2,3,3-tetramethylbutyl)imidazolidin-4-one
PubChem CID130666327
Molecular FormulaC11H22N2O
Molecular Weight198.31 g/mol
Exact Mass198.17
IUPAC Name3-(2,2,3,3-tetramethylbutyl)imidazolidin-4-one
SMILESCC(C)(C)C(C)(C)CN1CNCC1=O
InChIInChI=1S/C11H22N2O/c1-10(2,3)11(4,5)7-13-8-12-6-9(13)14/h12H,6-8H2,1-5H3
InChIKeyJJSYEQNEYMEINN-UHFFFAOYSA-N
XLogP1.45
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.31
LogP ≤ 51.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 3-(2,2,3,3-tetramethylbutyl)imidazolidin-4-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3-(2,2,3,3-tetramethylbutyl)imidazolidin-4-one?
The IUPAC name of 3-(2,2,3,3-tetramethylbutyl)imidazolidin-4-one (CID 130666327) is 3-(2,2,3,3-tetramethylbutyl)imidazolidin-4-one.
What is the SMILES notation for 3-(2,2,3,3-tetramethylbutyl)imidazolidin-4-one?
The canonical SMILES for 3-(2,2,3,3-tetramethylbutyl)imidazolidin-4-one is CC(C)(C)C(C)(C)CN1CNCC1=O.
What is the InChIKey of 3-(2,2,3,3-tetramethylbutyl)imidazolidin-4-one?
The InChIKey is JJSYEQNEYMEINN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O/c1-10(2,3)11(4,5)7-13-8-12-6-9(13)14/h12H,6-8H2,1-5H3.
What are the key properties of 3-(2,2,3,3-tetramethylbutyl)imidazolidin-4-one?
3-(2,2,3,3-tetramethylbutyl)imidazolidin-4-one has a molecular weight of 198.31 g/mol, XLogP of 1.45, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,2,3,3-tetramethylbutyl)imidazolidin-4-one is sourced from PubChem (CID 130666327), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).