3-(cyclohexylmethyl)-5-(2-methylpropyl)-2-propylimidazolidin-4-one

C17H32N2O — CID 83244505

IUPAC3-(cyclohexylmethyl)-5-(2-methylpropyl)-2-propylimidazolidin-4-one
SMILESCCCC1NC(CC(C)C)C(=O)N1CC1CCCCC1
InChIInChI=1S/C17H32N2O/c1-4-8-16-18-15(11-13(2)3)17(20)19(16)12-14-9-6-5-7-10-14/h13-16,18H,4-12H2,1-3H3
InChIKeyOPLMOWODWIVTGQ-UHFFFAOYSA-N
MW280.46 g/mol
LogP3.54
Rot. Bonds6

About 3-(cyclohexylmethyl)-5-(2-methylpropyl)-2-propylimidazolidin-4-one

3-(cyclohexylmethyl)-5-(2-methylpropyl)-2-propylimidazolidin-4-one (PubChem CID 83244505) has the molecular formula C17H32N2O and a molecular weight of 280.46 g/mol. Its IUPAC name is 3-(cyclohexylmethyl)-5-(2-methylpropyl)-2-propylimidazolidin-4-one.

Molecular Properties

Compound Name3-(cyclohexylmethyl)-5-(2-methylpropyl)-2-propylimidazolidin-4-one
PubChem CID83244505
Molecular FormulaC17H32N2O
Molecular Weight280.46 g/mol
Exact Mass280.25
IUPAC Name3-(cyclohexylmethyl)-5-(2-methylpropyl)-2-propylimidazolidin-4-one
SMILESCCCC1NC(CC(C)C)C(=O)N1CC1CCCCC1
InChIInChI=1S/C17H32N2O/c1-4-8-16-18-15(11-13(2)3)17(20)19(16)12-14-9-6-5-7-10-14/h13-16,18H,4-12H2,1-3H3
InChIKeyOPLMOWODWIVTGQ-UHFFFAOYSA-N
XLogP3.54
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.46
LogP ≤ 53.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-(2-cyclopentyloxyethyl)-5-(2-methylpropyl)-2-propylimidazolidin-4-one
CID 83264483
2-(2-methylpropyl)-3-(oxan-3-ylmethyl)-5-propylimidazolidin-4-one
CID 83250292
2-ethyl-5-(2-methylpropyl)-3-(oxan-3-ylmethyl)imidazolidin-4-one
CID 83250078
5-(2-methylpropyl)-3-[2-(oxolan-2-yl)ethyl]-2-propylimidazolidin-4-one
CID 83248880
1-(cyclopropylmethyl)-3-(2-methylpropyl)-6-propylpiperazine-2,5-dione
CID 64900957
3-(2-butoxyethyl)-5-(2-methylpropyl)-2-propylimidazolidin-4-one
CID 83253671
3-[(1,1-dioxothiolan-3-yl)methyl]-2-(2-methylpropyl)-5-propylimidazolidin-4-one
CID 83253548
5-(2-methylpropyl)-3-(2-methylsulfonylethyl)-2-propylimidazolidin-4-one
CID 83256860
5-butyl-3-(2-cyclopentylethyl)-2-(2-methylpropyl)imidazolidin-4-one
CID 83246039
3-(cyclobutylmethyl)-2-propan-2-yl-5-propylimidazolidin-4-one
CID 83243576
5-benzyl-3-(cyclopropylmethyl)-2-propylimidazolidin-4-one
CID 83251332
2-ethyl-5-(2-methylpropyl)-3-(oxan-2-ylmethyl)imidazolidin-4-one
CID 83255692

Frequently Asked Questions

What is the IUPAC name of 3-(cyclohexylmethyl)-5-(2-methylpropyl)-2-propylimidazolidin-4-one?
The IUPAC name of 3-(cyclohexylmethyl)-5-(2-methylpropyl)-2-propylimidazolidin-4-one (CID 83244505) is 3-(cyclohexylmethyl)-5-(2-methylpropyl)-2-propylimidazolidin-4-one.
What is the SMILES notation for 3-(cyclohexylmethyl)-5-(2-methylpropyl)-2-propylimidazolidin-4-one?
The canonical SMILES for 3-(cyclohexylmethyl)-5-(2-methylpropyl)-2-propylimidazolidin-4-one is CCCC1NC(CC(C)C)C(=O)N1CC1CCCCC1.
What is the InChIKey of 3-(cyclohexylmethyl)-5-(2-methylpropyl)-2-propylimidazolidin-4-one?
The InChIKey is OPLMOWODWIVTGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H32N2O/c1-4-8-16-18-15(11-13(2)3)17(20)19(16)12-14-9-6-5-7-10-14/h13-16,18H,4-12H2,1-3H3.
What are the key properties of 3-(cyclohexylmethyl)-5-(2-methylpropyl)-2-propylimidazolidin-4-one?
3-(cyclohexylmethyl)-5-(2-methylpropyl)-2-propylimidazolidin-4-one has a molecular weight of 280.46 g/mol, XLogP of 3.54, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(cyclohexylmethyl)-5-(2-methylpropyl)-2-propylimidazolidin-4-one is sourced from PubChem (CID 83244505), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).