3-tert-butyl-5,5-diphenylimidazolidine-2,4-dione

C19H20N2O2 — CID 13403875

IUPAC3-tert-butyl-5,5-diphenylimidazolidine-2,4-dione
SMILESCC(C)(C)N1C(=O)NC(c2ccccc2)(c2ccccc2)C1=O
InChIInChI=1S/C19H20N2O2/c1-18(2,3)21-16(22)19(20-17(21)23,14-10-6-4-7-11-14)15-12-8-5-9-13-15/h4-13H,1-3H3,(H,20,23)
InChIKeyGUHZQMSYQAXZPR-UHFFFAOYSA-N
MW308.38 g/mol
LogP3.28
Rot. Bonds2

About 3-tert-butyl-5,5-diphenylimidazolidine-2,4-dione

3-tert-butyl-5,5-diphenylimidazolidine-2,4-dione (PubChem CID 13403875) has the molecular formula C19H20N2O2 and a molecular weight of 308.38 g/mol. Its IUPAC name is 3-tert-butyl-5,5-diphenylimidazolidine-2,4-dione.

Molecular Properties

Compound Name3-tert-butyl-5,5-diphenylimidazolidine-2,4-dione
PubChem CID13403875
Molecular FormulaC19H20N2O2
Molecular Weight308.38 g/mol
Exact Mass308.15
IUPAC Name3-tert-butyl-5,5-diphenylimidazolidine-2,4-dione
SMILESCC(C)(C)N1C(=O)NC(c2ccccc2)(c2ccccc2)C1=O
InChIInChI=1S/C19H20N2O2/c1-18(2,3)21-16(22)19(20-17(21)23,14-10-6-4-7-11-14)15-12-8-5-9-13-15/h4-13H,1-3H3,(H,20,23)
InChIKeyGUHZQMSYQAXZPR-UHFFFAOYSA-N
XLogP3.28
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.38
LogP ≤ 53.28
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

3-(2-oxobutyl)-5,5-diphenylimidazolidine-2,4-dione
CID 51108463
3-decyl-5,5-diphenylimidazolidine-2,4-dione
CID 11696827
3-hexyl-5,5-diphenylimidazolidine-2,4-dione
CID 24860362
3-dimethoxyphosphoryl-5,5-diphenylimidazolidine-2,4-dione
CID 58600236
(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)phosphonic acid
CID 58600611
3-benzoyl-5,5-diphenylimidazolidine-2,4-dione
CID 101453416
N-tert-butyl-2-[(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)methyl-methylamino]acetamide
CID 9280956
3-[(4-methylphenyl)methyl]-5,5-diphenylimidazolidine-2,4-dione
CID 4810451
3-(2,2,3,3,4,4,4-heptafluorobutanoyl)-5,5-diphenylimidazolidine-2,4-dione
CID 91727424
5,5-diphenyl-3-(3-sulfanylpropyl)imidazolidine-2,4-dione
CID 102066490
2-[(2R)-1-(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)-2-methyl-3-oxopropan-2-yl]guanidine
CID 145280331
5,5-diphenyl-3-[2-(propan-2-ylamino)ethyl]imidazolidine-2,4-dione
CID 129132203

Frequently Asked Questions

What is the IUPAC name of 3-tert-butyl-5,5-diphenylimidazolidine-2,4-dione?
The IUPAC name of 3-tert-butyl-5,5-diphenylimidazolidine-2,4-dione (CID 13403875) is 3-tert-butyl-5,5-diphenylimidazolidine-2,4-dione.
What is the SMILES notation for 3-tert-butyl-5,5-diphenylimidazolidine-2,4-dione?
The canonical SMILES for 3-tert-butyl-5,5-diphenylimidazolidine-2,4-dione is CC(C)(C)N1C(=O)NC(c2ccccc2)(c2ccccc2)C1=O.
What is the InChIKey of 3-tert-butyl-5,5-diphenylimidazolidine-2,4-dione?
The InChIKey is GUHZQMSYQAXZPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2O2/c1-18(2,3)21-16(22)19(20-17(21)23,14-10-6-4-7-11-14)15-12-8-5-9-13-15/h4-13H,1-3H3,(H,20,23).
What are the key properties of 3-tert-butyl-5,5-diphenylimidazolidine-2,4-dione?
3-tert-butyl-5,5-diphenylimidazolidine-2,4-dione has a molecular weight of 308.38 g/mol, XLogP of 3.28, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-tert-butyl-5,5-diphenylimidazolidine-2,4-dione is sourced from PubChem (CID 13403875), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).