3-(3,4-dimethylcyclohexyl)-2,5-diethylimidazolidin-4-one

C15H28N2O — CID 83263458

IUPAC3-(3,4-dimethylcyclohexyl)-2,5-diethylimidazolidin-4-one
SMILESCCC1NC(CC)N(C2CCC(C)C(C)C2)C1=O
InChIInChI=1S/C15H28N2O/c1-5-13-15(18)17(14(6-2)16-13)12-8-7-10(3)11(4)9-12/h10-14,16H,5-9H2,1-4H3
InChIKeyADSDRTYBTFBEPB-UHFFFAOYSA-N
MW252.40 g/mol
LogP2.76
Rot. Bonds3

About 3-(3,4-dimethylcyclohexyl)-2,5-diethylimidazolidin-4-one

3-(3,4-dimethylcyclohexyl)-2,5-diethylimidazolidin-4-one (PubChem CID 83263458) has the molecular formula C15H28N2O and a molecular weight of 252.40 g/mol. Its IUPAC name is 3-(3,4-dimethylcyclohexyl)-2,5-diethylimidazolidin-4-one.

Molecular Properties

Compound Name3-(3,4-dimethylcyclohexyl)-2,5-diethylimidazolidin-4-one
PubChem CID83263458
Molecular FormulaC15H28N2O
Molecular Weight252.40 g/mol
Exact Mass252.22
IUPAC Name3-(3,4-dimethylcyclohexyl)-2,5-diethylimidazolidin-4-one
SMILESCCC1NC(CC)N(C2CCC(C)C(C)C2)C1=O
InChIInChI=1S/C15H28N2O/c1-5-13-15(18)17(14(6-2)16-13)12-8-7-10(3)11(4)9-12/h10-14,16H,5-9H2,1-4H3
InChIKeyADSDRTYBTFBEPB-UHFFFAOYSA-N
XLogP2.76
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.40
LogP ≤ 52.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-ethyl-3-(3-methylcyclopentyl)-2-propylimidazolidin-4-one
CID 114552240
3-(3,4-dimethylcyclohexyl)-2-(2-methylpropyl)-5-propylimidazolidin-4-one
CID 83263293
2,5-diethyl-3-(9-methyl-9-azabicyclo[3.3.1]nonan-3-yl)imidazolidin-4-one
CID 83263928
3-cyclopropyl-2-ethyl-5-methylimidazolidin-4-one
CID 83242202
2,5-diethyl-3-(thiolan-3-yl)imidazolidin-4-one
CID 103065473
5-butyl-2-ethyl-3-(4-methylcyclohexyl)imidazolidin-4-one
CID 83238921
1-(3,4-dimethylcyclohexyl)-6-ethyl-3-methylpiperazine-2,5-dione
CID 64973434
3-(3,5-dimethylcyclohexyl)-2-ethyl-5-propylimidazolidin-4-one
CID 83259395
2,5-diethyl-3-(2-ethylcyclohexyl)imidazolidin-4-one
CID 83249976
3-(1,1-dioxothian-4-yl)-5-ethyl-2-propylimidazolidin-4-one
CID 83244035
3-cyclooctyl-2-ethyl-5-propylimidazolidin-4-one
CID 83238796
5-butan-2-yl-3-(3,4-dimethylcyclohexyl)-2-methylimidazolidin-4-one
CID 83263151

Frequently Asked Questions

What is the IUPAC name of 3-(3,4-dimethylcyclohexyl)-2,5-diethylimidazolidin-4-one?
The IUPAC name of 3-(3,4-dimethylcyclohexyl)-2,5-diethylimidazolidin-4-one (CID 83263458) is 3-(3,4-dimethylcyclohexyl)-2,5-diethylimidazolidin-4-one.
What is the SMILES notation for 3-(3,4-dimethylcyclohexyl)-2,5-diethylimidazolidin-4-one?
The canonical SMILES for 3-(3,4-dimethylcyclohexyl)-2,5-diethylimidazolidin-4-one is CCC1NC(CC)N(C2CCC(C)C(C)C2)C1=O.
What is the InChIKey of 3-(3,4-dimethylcyclohexyl)-2,5-diethylimidazolidin-4-one?
The InChIKey is ADSDRTYBTFBEPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O/c1-5-13-15(18)17(14(6-2)16-13)12-8-7-10(3)11(4)9-12/h10-14,16H,5-9H2,1-4H3.
What are the key properties of 3-(3,4-dimethylcyclohexyl)-2,5-diethylimidazolidin-4-one?
3-(3,4-dimethylcyclohexyl)-2,5-diethylimidazolidin-4-one has a molecular weight of 252.40 g/mol, XLogP of 2.76, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3,4-dimethylcyclohexyl)-2,5-diethylimidazolidin-4-one is sourced from PubChem (CID 83263458), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).