3-[(4-ethylcyclohexyl)methyl]-2,5-dimethylimidazolidin-4-one

C14H26N2O — CID 83251966

IUPAC3-[(4-ethylcyclohexyl)methyl]-2,5-dimethylimidazolidin-4-one
SMILESCCC1CCC(CN2C(=O)C(C)NC2C)CC1
InChIInChI=1S/C14H26N2O/c1-4-12-5-7-13(8-6-12)9-16-11(3)15-10(2)14(16)17/h10-13,15H,4-9H2,1-3H3
InChIKeyGHPZNSOIFAGIED-UHFFFAOYSA-N
MW238.37 g/mol
LogP2.37
Rot. Bonds3

About 3-[(4-ethylcyclohexyl)methyl]-2,5-dimethylimidazolidin-4-one

3-[(4-ethylcyclohexyl)methyl]-2,5-dimethylimidazolidin-4-one (PubChem CID 83251966) has the molecular formula C14H26N2O and a molecular weight of 238.37 g/mol. Its IUPAC name is 3-[(4-ethylcyclohexyl)methyl]-2,5-dimethylimidazolidin-4-one.

Molecular Properties

Compound Name3-[(4-ethylcyclohexyl)methyl]-2,5-dimethylimidazolidin-4-one
PubChem CID83251966
Molecular FormulaC14H26N2O
Molecular Weight238.37 g/mol
Exact Mass238.20
IUPAC Name3-[(4-ethylcyclohexyl)methyl]-2,5-dimethylimidazolidin-4-one
SMILESCCC1CCC(CN2C(=O)C(C)NC2C)CC1
InChIInChI=1S/C14H26N2O/c1-4-12-5-7-13(8-6-12)9-16-11(3)15-10(2)14(16)17/h10-13,15H,4-9H2,1-3H3
InChIKeyGHPZNSOIFAGIED-UHFFFAOYSA-N
XLogP2.37
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.37
LogP ≤ 52.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-butyl-3-(cyclopropylmethyl)-2-methylimidazolidin-4-one
CID 83250992
5-ethyl-2-methyl-3-(oxan-4-ylmethyl)imidazolidin-4-one
CID 83257443
2-ethyl-5-methyl-3-(oxan-4-ylmethyl)imidazolidin-4-one
CID 83257022
2,5-dimethyl-3-(oxan-2-ylmethyl)imidazolidin-4-one
CID 83255693
3,6-diethyl-1-[(4-ethylcyclohexyl)methyl]piperazine-2,5-dione
CID 64968208
3-[(1,1-dioxothiolan-3-yl)methyl]-2-ethyl-5-methylimidazolidin-4-one
CID 83251863
2-cyclopentyl-3-(4-ethylcyclohexyl)-5-methylimidazolidin-4-one
CID 83256173
3-(2,2-dimethylpropyl)-2,5-dimethylimidazolidin-4-one
CID 83256720
2-cyclopentyl-5-methyl-3-[(3-methylcyclopentyl)methyl]imidazolidin-4-one
CID 107416109
2,5-dimethyl-3-(2,2,2-trifluoroethyl)imidazolidin-4-one
CID 83250601
2-(4-tert-butylphenyl)-3-(cyclopropylmethyl)-5-methylimidazolidin-4-one
CID 83247502
3-(cyclopropylmethyl)-5-methyl-2-(4-methylsulfanylphenyl)imidazolidin-4-one
CID 83250488

Frequently Asked Questions

What is the IUPAC name of 3-[(4-ethylcyclohexyl)methyl]-2,5-dimethylimidazolidin-4-one?
The IUPAC name of 3-[(4-ethylcyclohexyl)methyl]-2,5-dimethylimidazolidin-4-one (CID 83251966) is 3-[(4-ethylcyclohexyl)methyl]-2,5-dimethylimidazolidin-4-one.
What is the SMILES notation for 3-[(4-ethylcyclohexyl)methyl]-2,5-dimethylimidazolidin-4-one?
The canonical SMILES for 3-[(4-ethylcyclohexyl)methyl]-2,5-dimethylimidazolidin-4-one is CCC1CCC(CN2C(=O)C(C)NC2C)CC1.
What is the InChIKey of 3-[(4-ethylcyclohexyl)methyl]-2,5-dimethylimidazolidin-4-one?
The InChIKey is GHPZNSOIFAGIED-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O/c1-4-12-5-7-13(8-6-12)9-16-11(3)15-10(2)14(16)17/h10-13,15H,4-9H2,1-3H3.
What are the key properties of 3-[(4-ethylcyclohexyl)methyl]-2,5-dimethylimidazolidin-4-one?
3-[(4-ethylcyclohexyl)methyl]-2,5-dimethylimidazolidin-4-one has a molecular weight of 238.37 g/mol, XLogP of 2.37, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(4-ethylcyclohexyl)methyl]-2,5-dimethylimidazolidin-4-one is sourced from PubChem (CID 83251966), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).