2,5-dipropyl-3-(4-propylcyclohexyl)imidazolidin-4-one

C18H34N2O — CID 83252923

IUPAC2,5-dipropyl-3-(4-propylcyclohexyl)imidazolidin-4-one
SMILESCCCC1CCC(N2C(=O)C(CCC)NC2CCC)CC1
InChIInChI=1S/C18H34N2O/c1-4-7-14-10-12-15(13-11-14)20-17(9-6-3)19-16(8-5-2)18(20)21/h14-17,19H,4-13H2,1-3H3
InChIKeyYJJSIFUMYOJFOO-UHFFFAOYSA-N
MW294.48 g/mol
LogP4.07
Rot. Bonds7

About 2,5-dipropyl-3-(4-propylcyclohexyl)imidazolidin-4-one

2,5-dipropyl-3-(4-propylcyclohexyl)imidazolidin-4-one (PubChem CID 83252923) has the molecular formula C18H34N2O and a molecular weight of 294.48 g/mol. Its IUPAC name is 2,5-dipropyl-3-(4-propylcyclohexyl)imidazolidin-4-one.

Molecular Properties

Compound Name2,5-dipropyl-3-(4-propylcyclohexyl)imidazolidin-4-one
PubChem CID83252923
Molecular FormulaC18H34N2O
Molecular Weight294.48 g/mol
Exact Mass294.27
IUPAC Name2,5-dipropyl-3-(4-propylcyclohexyl)imidazolidin-4-one
SMILESCCCC1CCC(N2C(=O)C(CCC)NC2CCC)CC1
InChIInChI=1S/C18H34N2O/c1-4-7-14-10-12-15(13-11-14)20-17(9-6-3)19-16(8-5-2)18(20)21/h14-17,19H,4-13H2,1-3H3
InChIKeyYJJSIFUMYOJFOO-UHFFFAOYSA-N
XLogP4.07
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.48
LogP ≤ 54.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-(4-ethylcyclohexyl)-2,5-dipropylimidazolidin-4-one
CID 83255938
5-butyl-3-cyclooctyl-2-propylimidazolidin-4-one
CID 83238137
3-(1,1-dioxothian-4-yl)-5-ethyl-2-propylimidazolidin-4-one
CID 83244035
3-cyclooctyl-2-ethyl-5-propylimidazolidin-4-one
CID 83238796
3-(oxolan-3-yl)-2,5-dipropylimidazolidin-4-one
CID 83271242
5-ethyl-3-(3-methylcyclopentyl)-2-propylimidazolidin-4-one
CID 114552240
2-ethyl-3-(oxan-4-yl)-5-propylimidazolidin-4-one
CID 83256508
5-methyl-2-(2-methylpropyl)-3-(4-propylcyclohexyl)imidazolidin-4-one
CID 83249194
3-(1,2,3,5,6,7,8,8a-octahydroindolizin-7-yl)-2,5-dipropylimidazolidin-4-one
CID 83268918
5-butyl-2-ethyl-3-(4-methylcyclohexyl)imidazolidin-4-one
CID 83238921
5-butyl-3-(3-ethylcyclohexyl)-2-propylimidazolidin-4-one
CID 83266721
3-(3,5-dimethylcyclohexyl)-2-ethyl-5-propylimidazolidin-4-one
CID 83259395

Frequently Asked Questions

What is the IUPAC name of 2,5-dipropyl-3-(4-propylcyclohexyl)imidazolidin-4-one?
The IUPAC name of 2,5-dipropyl-3-(4-propylcyclohexyl)imidazolidin-4-one (CID 83252923) is 2,5-dipropyl-3-(4-propylcyclohexyl)imidazolidin-4-one.
What is the SMILES notation for 2,5-dipropyl-3-(4-propylcyclohexyl)imidazolidin-4-one?
The canonical SMILES for 2,5-dipropyl-3-(4-propylcyclohexyl)imidazolidin-4-one is CCCC1CCC(N2C(=O)C(CCC)NC2CCC)CC1.
What is the InChIKey of 2,5-dipropyl-3-(4-propylcyclohexyl)imidazolidin-4-one?
The InChIKey is YJJSIFUMYOJFOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H34N2O/c1-4-7-14-10-12-15(13-11-14)20-17(9-6-3)19-16(8-5-2)18(20)21/h14-17,19H,4-13H2,1-3H3.
What are the key properties of 2,5-dipropyl-3-(4-propylcyclohexyl)imidazolidin-4-one?
2,5-dipropyl-3-(4-propylcyclohexyl)imidazolidin-4-one has a molecular weight of 294.48 g/mol, XLogP of 4.07, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dipropyl-3-(4-propylcyclohexyl)imidazolidin-4-one is sourced from PubChem (CID 83252923), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).