5-(2-methylpropyl)-3-(3,3,5,5-tetramethylcyclohexyl)imidazolidin-4-one

C17H32N2O — CID 103968852

IUPAC5-(2-methylpropyl)-3-(3,3,5,5-tetramethylcyclohexyl)imidazolidin-4-one
SMILESCC(C)CC1NCN(C2CC(C)(C)CC(C)(C)C2)C1=O
InChIInChI=1S/C17H32N2O/c1-12(2)7-14-15(20)19(11-18-14)13-8-16(3,4)10-17(5,6)9-13/h12-14,18H,7-11H2,1-6H3
InChIKeyCDXZYYHSFHKWBT-UHFFFAOYSA-N
MW280.46 g/mol
LogP3.40
Rot. Bonds3

About 5-(2-methylpropyl)-3-(3,3,5,5-tetramethylcyclohexyl)imidazolidin-4-one

5-(2-methylpropyl)-3-(3,3,5,5-tetramethylcyclohexyl)imidazolidin-4-one (PubChem CID 103968852) has the molecular formula C17H32N2O and a molecular weight of 280.46 g/mol. Its IUPAC name is 5-(2-methylpropyl)-3-(3,3,5,5-tetramethylcyclohexyl)imidazolidin-4-one.

Molecular Properties

Compound Name5-(2-methylpropyl)-3-(3,3,5,5-tetramethylcyclohexyl)imidazolidin-4-one
PubChem CID103968852
Molecular FormulaC17H32N2O
Molecular Weight280.46 g/mol
Exact Mass280.25
IUPAC Name5-(2-methylpropyl)-3-(3,3,5,5-tetramethylcyclohexyl)imidazolidin-4-one
SMILESCC(C)CC1NCN(C2CC(C)(C)CC(C)(C)C2)C1=O
InChIInChI=1S/C17H32N2O/c1-12(2)7-14-15(20)19(11-18-14)13-8-16(3,4)10-17(5,6)9-13/h12-14,18H,7-11H2,1-6H3
InChIKeyCDXZYYHSFHKWBT-UHFFFAOYSA-N
XLogP3.40
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.46
LogP ≤ 53.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-butyl-3-(3,3,5,5-tetramethylcyclohexyl)imidazolidin-4-one
CID 103968821
3-(3,4-dimethylcyclohexyl)-5-(2-methylpropyl)imidazolidin-4-one
CID 83262674
5-(2-methylpropyl)-3-pentan-3-ylimidazolidin-4-one
CID 83242760
5-(2-methylpropyl)-3-[(2,2,3,3-tetramethylcyclopropyl)methyl]imidazolidin-4-one
CID 83258955
3-(3,3-dimethylbutan-2-yl)-5-(2-methylpropyl)imidazolidin-4-one
CID 104830706
1-(4,4-dimethylcyclohexyl)-3-(2-methylpropyl)piperazine-2,5-dione
CID 64972851
3-(3-ethyl-2-methylcyclopentyl)-5-(2-methylpropyl)imidazolidin-4-one
CID 83258722
3-(1-cyclopropylpropan-2-yl)-5-(2-methylpropyl)imidazolidin-4-one
CID 83257317
3-(1,3-dimethylpiperidin-4-yl)-5-(2-methylpropyl)imidazolidin-4-one
CID 114507163
3-(3-methylbutyl)-5-(2-methylpropyl)imidazolidin-4-one
CID 83238290
3-heptan-2-yl-5-(2-methylpropyl)imidazolidin-4-one
CID 83254098
3-(1-methoxybutan-2-yl)-5-(2-methylpropyl)imidazolidin-4-one
CID 83258633

Frequently Asked Questions

What is the IUPAC name of 5-(2-methylpropyl)-3-(3,3,5,5-tetramethylcyclohexyl)imidazolidin-4-one?
The IUPAC name of 5-(2-methylpropyl)-3-(3,3,5,5-tetramethylcyclohexyl)imidazolidin-4-one (CID 103968852) is 5-(2-methylpropyl)-3-(3,3,5,5-tetramethylcyclohexyl)imidazolidin-4-one.
What is the SMILES notation for 5-(2-methylpropyl)-3-(3,3,5,5-tetramethylcyclohexyl)imidazolidin-4-one?
The canonical SMILES for 5-(2-methylpropyl)-3-(3,3,5,5-tetramethylcyclohexyl)imidazolidin-4-one is CC(C)CC1NCN(C2CC(C)(C)CC(C)(C)C2)C1=O.
What is the InChIKey of 5-(2-methylpropyl)-3-(3,3,5,5-tetramethylcyclohexyl)imidazolidin-4-one?
The InChIKey is CDXZYYHSFHKWBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H32N2O/c1-12(2)7-14-15(20)19(11-18-14)13-8-16(3,4)10-17(5,6)9-13/h12-14,18H,7-11H2,1-6H3.
What are the key properties of 5-(2-methylpropyl)-3-(3,3,5,5-tetramethylcyclohexyl)imidazolidin-4-one?
5-(2-methylpropyl)-3-(3,3,5,5-tetramethylcyclohexyl)imidazolidin-4-one has a molecular weight of 280.46 g/mol, XLogP of 3.40, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-methylpropyl)-3-(3,3,5,5-tetramethylcyclohexyl)imidazolidin-4-one is sourced from PubChem (CID 103968852), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).