3-(3,4-dimethylcyclohexyl)-2-(2-methylpropyl)-5-propylimidazolidin-4-one

C18H34N2O — CID 83263293

IUPAC3-(3,4-dimethylcyclohexyl)-2-(2-methylpropyl)-5-propylimidazolidin-4-one
SMILESCCCC1NC(CC(C)C)N(C2CCC(C)C(C)C2)C1=O
InChIInChI=1S/C18H34N2O/c1-6-7-16-18(21)20(17(19-16)10-12(2)3)15-9-8-13(4)14(5)11-15/h12-17,19H,6-11H2,1-5H3
InChIKeyNKBDAPXHDFZZEN-UHFFFAOYSA-N
MW294.48 g/mol
LogP3.78
Rot. Bonds5

About 3-(3,4-dimethylcyclohexyl)-2-(2-methylpropyl)-5-propylimidazolidin-4-one

3-(3,4-dimethylcyclohexyl)-2-(2-methylpropyl)-5-propylimidazolidin-4-one (PubChem CID 83263293) has the molecular formula C18H34N2O and a molecular weight of 294.48 g/mol. Its IUPAC name is 3-(3,4-dimethylcyclohexyl)-2-(2-methylpropyl)-5-propylimidazolidin-4-one.

Molecular Properties

Compound Name3-(3,4-dimethylcyclohexyl)-2-(2-methylpropyl)-5-propylimidazolidin-4-one
PubChem CID83263293
Molecular FormulaC18H34N2O
Molecular Weight294.48 g/mol
Exact Mass294.27
IUPAC Name3-(3,4-dimethylcyclohexyl)-2-(2-methylpropyl)-5-propylimidazolidin-4-one
SMILESCCCC1NC(CC(C)C)N(C2CCC(C)C(C)C2)C1=O
InChIInChI=1S/C18H34N2O/c1-6-7-16-18(21)20(17(19-16)10-12(2)3)15-9-8-13(4)14(5)11-15/h12-17,19H,6-11H2,1-5H3
InChIKeyNKBDAPXHDFZZEN-UHFFFAOYSA-N
XLogP3.78
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.48
LogP ≤ 53.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-(3,4-dimethylcyclohexyl)-2,5-diethylimidazolidin-4-one
CID 83263458
5-methyl-2-(2-methylpropyl)-3-(4-propylcyclohexyl)imidazolidin-4-one
CID 83249194
3-(2-ethylcyclohexyl)-2-(2-methylpropyl)-5-propylimidazolidin-4-one
CID 83253814
5-butan-2-yl-3-(3-methylcyclopentyl)-2-(2-methylpropyl)imidazolidin-4-one
CID 114552346
2-(2-methylpropyl)-3-(7-oxabicyclo[2.2.1]heptan-2-yl)-5-propylimidazolidin-4-one
CID 83271173
5-ethyl-3-(3-methylcyclopentyl)-2-propylimidazolidin-4-one
CID 114552240
2,5-dipropyl-3-(4-propylcyclohexyl)imidazolidin-4-one
CID 83252923
6-(3,4-dimethylcyclohexyl)-5-(2-methylpropyl)-4,6-diazaspiro[2.4]heptan-7-one
CID 83263149
3-(3,5-dimethylcyclohexyl)-2-ethyl-5-propylimidazolidin-4-one
CID 83259395
3-(4-ethylcyclohexyl)-2,5-dipropylimidazolidin-4-one
CID 83255938
5-ethyl-3-(2-methylcyclopentyl)-2-(2-methylpropyl)imidazolidin-4-one
CID 83257488
2-(2-methylpropyl)-3,5-dipropylimidazolidin-4-one
CID 83242530

Frequently Asked Questions

What is the IUPAC name of 3-(3,4-dimethylcyclohexyl)-2-(2-methylpropyl)-5-propylimidazolidin-4-one?
The IUPAC name of 3-(3,4-dimethylcyclohexyl)-2-(2-methylpropyl)-5-propylimidazolidin-4-one (CID 83263293) is 3-(3,4-dimethylcyclohexyl)-2-(2-methylpropyl)-5-propylimidazolidin-4-one.
What is the SMILES notation for 3-(3,4-dimethylcyclohexyl)-2-(2-methylpropyl)-5-propylimidazolidin-4-one?
The canonical SMILES for 3-(3,4-dimethylcyclohexyl)-2-(2-methylpropyl)-5-propylimidazolidin-4-one is CCCC1NC(CC(C)C)N(C2CCC(C)C(C)C2)C1=O.
What is the InChIKey of 3-(3,4-dimethylcyclohexyl)-2-(2-methylpropyl)-5-propylimidazolidin-4-one?
The InChIKey is NKBDAPXHDFZZEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H34N2O/c1-6-7-16-18(21)20(17(19-16)10-12(2)3)15-9-8-13(4)14(5)11-15/h12-17,19H,6-11H2,1-5H3.
What are the key properties of 3-(3,4-dimethylcyclohexyl)-2-(2-methylpropyl)-5-propylimidazolidin-4-one?
3-(3,4-dimethylcyclohexyl)-2-(2-methylpropyl)-5-propylimidazolidin-4-one has a molecular weight of 294.48 g/mol, XLogP of 3.78, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3,4-dimethylcyclohexyl)-2-(2-methylpropyl)-5-propylimidazolidin-4-one is sourced from PubChem (CID 83263293), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).