5-propan-2-yl-3-(4-propylcyclohexyl)imidazolidin-4-one

C15H28N2O — CID 83249820

IUPAC5-propan-2-yl-3-(4-propylcyclohexyl)imidazolidin-4-one
SMILESCCCC1CCC(N2CNC(C(C)C)C2=O)CC1
InChIInChI=1S/C15H28N2O/c1-4-5-12-6-8-13(9-7-12)17-10-16-14(11(2)3)15(17)18/h11-14,16H,4-10H2,1-3H3
InChIKeyZTAIGHOEQBWEIM-UHFFFAOYSA-N
MW252.40 g/mol
LogP2.76
Rot. Bonds4

About 5-propan-2-yl-3-(4-propylcyclohexyl)imidazolidin-4-one

5-propan-2-yl-3-(4-propylcyclohexyl)imidazolidin-4-one (PubChem CID 83249820) has the molecular formula C15H28N2O and a molecular weight of 252.40 g/mol. Its IUPAC name is 5-propan-2-yl-3-(4-propylcyclohexyl)imidazolidin-4-one.

Molecular Properties

Compound Name5-propan-2-yl-3-(4-propylcyclohexyl)imidazolidin-4-one
PubChem CID83249820
Molecular FormulaC15H28N2O
Molecular Weight252.40 g/mol
Exact Mass252.22
IUPAC Name5-propan-2-yl-3-(4-propylcyclohexyl)imidazolidin-4-one
SMILESCCCC1CCC(N2CNC(C(C)C)C2=O)CC1
InChIInChI=1S/C15H28N2O/c1-4-5-12-6-8-13(9-7-12)17-10-16-14(11(2)3)15(17)18/h11-14,16H,4-10H2,1-3H3
InChIKeyZTAIGHOEQBWEIM-UHFFFAOYSA-N
XLogP2.76
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
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

3-(2-cyclopropylethyl)-5-propan-2-ylimidazolidin-4-one
CID 83258288
3-(1-ethylpiperidin-3-yl)-5-propan-2-ylimidazolidin-4-one
CID 83247949
5-methyl-2-(2-methylpropyl)-3-(4-propylcyclohexyl)imidazolidin-4-one
CID 83249194
1-(4-propylcyclohexyl)-1,3-diazinan-2-one
CID 115371043
3-(1-methylpiperidin-4-yl)-5-propylimidazolidin-4-one
CID 83244074
2,5-dipropyl-3-(4-propylcyclohexyl)imidazolidin-4-one
CID 83252923
3-[(4-methylcyclohexyl)methyl]-5-propan-2-yl-2-propylimidazolidin-4-one
CID 83254528
3-(oxan-4-yl)-5-propan-2-yl-2-propylimidazolidin-4-one
CID 83256757
2-ethyl-3-[2-(4-methylcyclohexyl)ethyl]-5-propan-2-ylimidazolidin-4-one
CID 83263281
2-propan-2-yl-5-propyl-1-(4-propylcyclohexyl)piperazine
CID 64946683
4-(4-propylcyclohexyl)piperazine-2,6-dione
CID 55235193
1-cyclopropyl-3-propan-2-yl-1,4-diazepane-2,5-dione
CID 64958484

Frequently Asked Questions

What is the IUPAC name of 5-propan-2-yl-3-(4-propylcyclohexyl)imidazolidin-4-one?
The IUPAC name of 5-propan-2-yl-3-(4-propylcyclohexyl)imidazolidin-4-one (CID 83249820) is 5-propan-2-yl-3-(4-propylcyclohexyl)imidazolidin-4-one.
What is the SMILES notation for 5-propan-2-yl-3-(4-propylcyclohexyl)imidazolidin-4-one?
The canonical SMILES for 5-propan-2-yl-3-(4-propylcyclohexyl)imidazolidin-4-one is CCCC1CCC(N2CNC(C(C)C)C2=O)CC1.
What is the InChIKey of 5-propan-2-yl-3-(4-propylcyclohexyl)imidazolidin-4-one?
The InChIKey is ZTAIGHOEQBWEIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O/c1-4-5-12-6-8-13(9-7-12)17-10-16-14(11(2)3)15(17)18/h11-14,16H,4-10H2,1-3H3.
What are the key properties of 5-propan-2-yl-3-(4-propylcyclohexyl)imidazolidin-4-one?
5-propan-2-yl-3-(4-propylcyclohexyl)imidazolidin-4-one has a molecular weight of 252.40 g/mol, XLogP of 2.76, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-propan-2-yl-3-(4-propylcyclohexyl)imidazolidin-4-one is sourced from PubChem (CID 83249820), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).