1-tert-butyl-3-(4-tert-butylcyclohexyl)imidazolidin-2-one

C17H32N2O — CID 59476386

IUPAC1-tert-butyl-3-(4-tert-butylcyclohexyl)imidazolidin-2-one
SMILESCC(C)(C)C1CCC(N2CCN(C(C)(C)C)C2=O)CC1
InChIInChI=1S/C17H32N2O/c1-16(2,3)13-7-9-14(10-8-13)18-11-12-19(15(18)20)17(4,5)6/h13-14H,7-12H2,1-6H3
InChIKeyBJUOBIGURSKTMV-UHFFFAOYSA-N
MW280.46 g/mol
LogP4.13
Rot. Bonds1

About 1-tert-butyl-3-(4-tert-butylcyclohexyl)imidazolidin-2-one

1-tert-butyl-3-(4-tert-butylcyclohexyl)imidazolidin-2-one (PubChem CID 59476386) has the molecular formula C17H32N2O and a molecular weight of 280.46 g/mol. Its IUPAC name is 1-tert-butyl-3-(4-tert-butylcyclohexyl)imidazolidin-2-one.

Molecular Properties

Compound Name1-tert-butyl-3-(4-tert-butylcyclohexyl)imidazolidin-2-one
PubChem CID59476386
Molecular FormulaC17H32N2O
Molecular Weight280.46 g/mol
Exact Mass280.25
IUPAC Name1-tert-butyl-3-(4-tert-butylcyclohexyl)imidazolidin-2-one
SMILESCC(C)(C)C1CCC(N2CCN(C(C)(C)C)C2=O)CC1
InChIInChI=1S/C17H32N2O/c1-16(2,3)13-7-9-14(10-8-13)18-11-12-19(15(18)20)17(4,5)6/h13-14H,7-12H2,1-6H3
InChIKeyBJUOBIGURSKTMV-UHFFFAOYSA-N
XLogP4.13
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.46
LogP ≤ 54.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

3-(2-Cyclohexylethyl)-4,4-dimethyl-1-propan-2-ylimidazolidin-2-one
CID 21025481
1,3-Bis(5-methyl-2-propan-2-ylcyclohexyl)imidazolidin-2-one
CID 21263550
1-(4-Tert-butylcyclohexyl)imidazolidin-2-one
CID 58395007
3-(dimethylamino)-N-[1-(4,4-dimethylcyclohexyl)pyrrolidin-3-yl]-N-methylpyrrolidine-1-carboxamide
CID 58689039
1-(4-Tert-butylcyclohexyl)-3-ethylimidazolidin-2-one
CID 70849900
1-Ethyl-3-(4-ethylcyclohexyl)imidazolidin-2-one
CID 70849957
(4S)-4-tert-butyl-1-[1-(3-ethyl-5-methylcyclohexyl)ethyl]-3-methylimidazolidin-2-one
CID 70861269
3-(2-Cyclohexylethyl)-1,4,4-trimethylimidazolidin-2-one
CID 71093971
4-Cyclohexyl-1,3-dimethylimidazolidin-2-one
CID 82646916
1-Methyl-3-(4-methylcyclohexyl)imidazolidin-2-one
CID 89949793
1-Tert-butyl-3-(2,5,5,9,9-pentamethyldecan-2-yl)imidazolidin-2-one
CID 132011817
1,3-Bis(4-methylcyclohexyl)imidazolidin-2-one
CID 139926672

Frequently Asked Questions

What is the IUPAC name of 1-tert-butyl-3-(4-tert-butylcyclohexyl)imidazolidin-2-one?
The IUPAC name of 1-tert-butyl-3-(4-tert-butylcyclohexyl)imidazolidin-2-one (CID 59476386) is 1-tert-butyl-3-(4-tert-butylcyclohexyl)imidazolidin-2-one.
What is the SMILES notation for 1-tert-butyl-3-(4-tert-butylcyclohexyl)imidazolidin-2-one?
The canonical SMILES for 1-tert-butyl-3-(4-tert-butylcyclohexyl)imidazolidin-2-one is CC(C)(C)C1CCC(N2CCN(C(C)(C)C)C2=O)CC1.
What is the InChIKey of 1-tert-butyl-3-(4-tert-butylcyclohexyl)imidazolidin-2-one?
The InChIKey is BJUOBIGURSKTMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H32N2O/c1-16(2,3)13-7-9-14(10-8-13)18-11-12-19(15(18)20)17(4,5)6/h13-14H,7-12H2,1-6H3.
What are the key properties of 1-tert-butyl-3-(4-tert-butylcyclohexyl)imidazolidin-2-one?
1-tert-butyl-3-(4-tert-butylcyclohexyl)imidazolidin-2-one has a molecular weight of 280.46 g/mol, XLogP of 4.13, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-tert-butyl-3-(4-tert-butylcyclohexyl)imidazolidin-2-one is sourced from PubChem (CID 59476386), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).