5,5-dimethyl-3-(2,2,5,5-tetramethylheptan-4-yl)imidazolidine-2,4-dione

C16H30N2O2 — CID 143659362

IUPAC5,5-dimethyl-3-(2,2,5,5-tetramethylheptan-4-yl)imidazolidine-2,4-dione
SMILESCCC(C)(C)C(CC(C)(C)C)N1C(=O)NC(C)(C)C1=O
InChIInChI=1S/C16H30N2O2/c1-9-15(5,6)11(10-14(2,3)4)18-12(19)16(7,8)17-13(18)20/h11H,9-10H2,1-8H3,(H,17,20)
InChIKeyGVJPCPOCLLOAEU-UHFFFAOYSA-N
MW282.43 g/mol
LogP3.56
Rot. Bonds4

About 5,5-dimethyl-3-(2,2,5,5-tetramethylheptan-4-yl)imidazolidine-2,4-dione

5,5-dimethyl-3-(2,2,5,5-tetramethylheptan-4-yl)imidazolidine-2,4-dione (PubChem CID 143659362) has the molecular formula C16H30N2O2 and a molecular weight of 282.43 g/mol. Its IUPAC name is 5,5-dimethyl-3-(2,2,5,5-tetramethylheptan-4-yl)imidazolidine-2,4-dione.

Molecular Properties

Compound Name5,5-dimethyl-3-(2,2,5,5-tetramethylheptan-4-yl)imidazolidine-2,4-dione
PubChem CID143659362
Molecular FormulaC16H30N2O2
Molecular Weight282.43 g/mol
Exact Mass282.23
IUPAC Name5,5-dimethyl-3-(2,2,5,5-tetramethylheptan-4-yl)imidazolidine-2,4-dione
SMILESCCC(C)(C)C(CC(C)(C)C)N1C(=O)NC(C)(C)C1=O
InChIInChI=1S/C16H30N2O2/c1-9-15(5,6)11(10-14(2,3)4)18-12(19)16(7,8)17-13(18)20/h11H,9-10H2,1-8H3,(H,17,20)
InChIKeyGVJPCPOCLLOAEU-UHFFFAOYSA-N
XLogP3.56
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.43
LogP ≤ 53.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydantoin', 'substructure': 'N/A'}

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Related Compounds

2-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-(4-methylcyclohexyl)acetamide
CID 24982857
2-(2,4-dioxo-1,3-diazaspiro[4.6]undecan-3-yl)-N,N-di(propan-2-yl)acetamide
CID 2578454
2-(2,5-dioxo-4,4-dipropylimidazolidin-1-yl)-N-methylacetamide
CID 17403905
3-[2-(2,6-Dimethylpiperidin-1-yl)-2-oxoethyl]-5,5-dipropylimidazolidine-2,4-dione
CID 24326465
3-[2-[Cycloheptyl(methyl)amino]ethyl]-5,5-dimethylimidazolidine-2,4-dione
CID 34195722
5,5-Diethyl-3-[2-(2-ethyl-4-methylpyrrolidin-1-yl)-2-oxoethyl]imidazolidine-2,4-dione
CID 72114379
2-[3-(Cycloheptylmethyl)-5,5-dimethyl-2,4-dioxoimidazolidin-1-yl]acetamide
CID 132306071
[3-[(4-Amino-1-methylcyclohexyl)methyl]-4,4-dimethyl-2,5-dioxoimidazolidin-1-yl] thiohypofluorite
CID 178761419
2-(2,5-Dioxo-4,4-dipropylimidazolidin-1-yl)acetamide
CID 289055
2-(2,4-dioxo-1,3-diazaspiro[4.7]dodecan-3-yl)-N-pentan-3-ylacetamide
CID 2583648
N-cycloheptyl-2-(2,5-dioxo-4,4-dipropylimidazolidin-1-yl)acetamide
CID 8362565
3-(3,3-Dimethyl-2-oxobutyl)-5-ethyl-5-propan-2-ylimidazolidine-2,4-dione
CID 53600590

Frequently Asked Questions

What is the IUPAC name of 5,5-dimethyl-3-(2,2,5,5-tetramethylheptan-4-yl)imidazolidine-2,4-dione?
The IUPAC name of 5,5-dimethyl-3-(2,2,5,5-tetramethylheptan-4-yl)imidazolidine-2,4-dione (CID 143659362) is 5,5-dimethyl-3-(2,2,5,5-tetramethylheptan-4-yl)imidazolidine-2,4-dione.
What is the SMILES notation for 5,5-dimethyl-3-(2,2,5,5-tetramethylheptan-4-yl)imidazolidine-2,4-dione?
The canonical SMILES for 5,5-dimethyl-3-(2,2,5,5-tetramethylheptan-4-yl)imidazolidine-2,4-dione is CCC(C)(C)C(CC(C)(C)C)N1C(=O)NC(C)(C)C1=O.
What is the InChIKey of 5,5-dimethyl-3-(2,2,5,5-tetramethylheptan-4-yl)imidazolidine-2,4-dione?
The InChIKey is GVJPCPOCLLOAEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30N2O2/c1-9-15(5,6)11(10-14(2,3)4)18-12(19)16(7,8)17-13(18)20/h11H,9-10H2,1-8H3,(H,17,20).
What are the key properties of 5,5-dimethyl-3-(2,2,5,5-tetramethylheptan-4-yl)imidazolidine-2,4-dione?
5,5-dimethyl-3-(2,2,5,5-tetramethylheptan-4-yl)imidazolidine-2,4-dione has a molecular weight of 282.43 g/mol, XLogP of 3.56, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5,5-dimethyl-3-(2,2,5,5-tetramethylheptan-4-yl)imidazolidine-2,4-dione is sourced from PubChem (CID 143659362), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).