3-(2-cyclohexylethyl)-1,4,4-trimethylimidazolidin-2-one

C14H26N2O — CID 71093971

IUPAC3-(2-cyclohexylethyl)-1,4,4-trimethylimidazolidin-2-one
SMILESCN1CC(C)(C)N(CCC2CCCCC2)C1=O
InChIInChI=1S/C14H26N2O/c1-14(2)11-15(3)13(17)16(14)10-9-12-7-5-4-6-8-12/h12H,4-11H2,1-3H3
InChIKeyYISYRRMJUMZSAS-UHFFFAOYSA-N
MW238.37 g/mol
LogP3.10
Rot. Bonds3

About 3-(2-cyclohexylethyl)-1,4,4-trimethylimidazolidin-2-one

3-(2-cyclohexylethyl)-1,4,4-trimethylimidazolidin-2-one (PubChem CID 71093971) has the molecular formula C14H26N2O and a molecular weight of 238.37 g/mol. Its IUPAC name is 3-(2-cyclohexylethyl)-1,4,4-trimethylimidazolidin-2-one.

Molecular Properties

Compound Name3-(2-cyclohexylethyl)-1,4,4-trimethylimidazolidin-2-one
PubChem CID71093971
Molecular FormulaC14H26N2O
Molecular Weight238.37 g/mol
Exact Mass238.20
IUPAC Name3-(2-cyclohexylethyl)-1,4,4-trimethylimidazolidin-2-one
SMILESCN1CC(C)(C)N(CCC2CCCCC2)C1=O
InChIInChI=1S/C14H26N2O/c1-14(2)11-15(3)13(17)16(14)10-9-12-7-5-4-6-8-12/h12H,4-11H2,1-3H3
InChIKeyYISYRRMJUMZSAS-UHFFFAOYSA-N
XLogP3.10
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.37
LogP ≤ 53.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 3-(2-cyclohexylethyl)-1,4,4-trimethylimidazolidin-2-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-cyclohexylethyl)-1,4,4-trimethylimidazolidin-2-one?
The IUPAC name of 3-(2-cyclohexylethyl)-1,4,4-trimethylimidazolidin-2-one (CID 71093971) is 3-(2-cyclohexylethyl)-1,4,4-trimethylimidazolidin-2-one.
What is the SMILES notation for 3-(2-cyclohexylethyl)-1,4,4-trimethylimidazolidin-2-one?
The canonical SMILES for 3-(2-cyclohexylethyl)-1,4,4-trimethylimidazolidin-2-one is CN1CC(C)(C)N(CCC2CCCCC2)C1=O.
What is the InChIKey of 3-(2-cyclohexylethyl)-1,4,4-trimethylimidazolidin-2-one?
The InChIKey is YISYRRMJUMZSAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O/c1-14(2)11-15(3)13(17)16(14)10-9-12-7-5-4-6-8-12/h12H,4-11H2,1-3H3.
What are the key properties of 3-(2-cyclohexylethyl)-1,4,4-trimethylimidazolidin-2-one?
3-(2-cyclohexylethyl)-1,4,4-trimethylimidazolidin-2-one has a molecular weight of 238.37 g/mol, XLogP of 3.10, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-cyclohexylethyl)-1,4,4-trimethylimidazolidin-2-one is sourced from PubChem (CID 71093971), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).