3-(2-oxobutyl)-5,5-diphenylimidazolidine-2,4-dione

C19H18N2O3 — CID 51108463

IUPAC3-(2-oxobutyl)-5,5-diphenylimidazolidine-2,4-dione
SMILESCCC(=O)CN1C(=O)NC(c2ccccc2)(c2ccccc2)C1=O
InChIInChI=1S/C19H18N2O3/c1-2-16(22)13-21-17(23)19(20-18(21)24,14-9-5-3-6-10-14)15-11-7-4-8-12-15/h3-12H,2,13H2,1H3,(H,20,24)
InChIKeyGLAZEKDZSWLPRA-UHFFFAOYSA-N
MW322.36 g/mol
LogP2.46
Rot. Bonds5

About 3-(2-oxobutyl)-5,5-diphenylimidazolidine-2,4-dione

3-(2-oxobutyl)-5,5-diphenylimidazolidine-2,4-dione (PubChem CID 51108463) has the molecular formula C19H18N2O3 and a molecular weight of 322.36 g/mol. Its IUPAC name is 3-(2-oxobutyl)-5,5-diphenylimidazolidine-2,4-dione.

Molecular Properties

Compound Name3-(2-oxobutyl)-5,5-diphenylimidazolidine-2,4-dione
PubChem CID51108463
Molecular FormulaC19H18N2O3
Molecular Weight322.36 g/mol
Exact Mass322.13
IUPAC Name3-(2-oxobutyl)-5,5-diphenylimidazolidine-2,4-dione
SMILESCCC(=O)CN1C(=O)NC(c2ccccc2)(c2ccccc2)C1=O
InChIInChI=1S/C19H18N2O3/c1-2-16(22)13-21-17(23)19(20-18(21)24,14-9-5-3-6-10-14)15-11-7-4-8-12-15/h3-12H,2,13H2,1H3,(H,20,24)
InChIKeyGLAZEKDZSWLPRA-UHFFFAOYSA-N
XLogP2.46
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.36
LogP ≤ 52.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

3-decyl-5,5-diphenylimidazolidine-2,4-dione
CID 11696827
3-hexyl-5,5-diphenylimidazolidine-2,4-dione
CID 24860362
2-(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)-N-(4-methylphenyl)acetamide
CID 84601269
2-(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)-N-(6-methylheptan-2-yl)acetamide
CID 46606290
N-(2-bromophenyl)-2-(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)acetamide
CID 4045289
ethyl 2-[[2-(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)acetyl]amino]benzoate
CID 4855786
2-(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)-N-[2-(4-ethoxyphenoxy)ethyl]acetamide
CID 27926091
2-(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)-N-[(2-methoxyphenyl)methyl]acetamide
CID 2117749
S-[(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)methyl] 2-aminoethanethioate
CID 54266354
3-tert-butyl-5,5-diphenylimidazolidine-2,4-dione
CID 13403875
ethyl 5-[2-(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)acetyl]-2,4-dimethyl-1H-pyrrole-3-carboxylate
CID 2423832
N-[(1R)-1-(4-bromophenyl)ethyl]-2-(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)acetamide
CID 41079592

Frequently Asked Questions

What is the IUPAC name of 3-(2-oxobutyl)-5,5-diphenylimidazolidine-2,4-dione?
The IUPAC name of 3-(2-oxobutyl)-5,5-diphenylimidazolidine-2,4-dione (CID 51108463) is 3-(2-oxobutyl)-5,5-diphenylimidazolidine-2,4-dione.
What is the SMILES notation for 3-(2-oxobutyl)-5,5-diphenylimidazolidine-2,4-dione?
The canonical SMILES for 3-(2-oxobutyl)-5,5-diphenylimidazolidine-2,4-dione is CCC(=O)CN1C(=O)NC(c2ccccc2)(c2ccccc2)C1=O.
What is the InChIKey of 3-(2-oxobutyl)-5,5-diphenylimidazolidine-2,4-dione?
The InChIKey is GLAZEKDZSWLPRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N2O3/c1-2-16(22)13-21-17(23)19(20-18(21)24,14-9-5-3-6-10-14)15-11-7-4-8-12-15/h3-12H,2,13H2,1H3,(H,20,24).
What are the key properties of 3-(2-oxobutyl)-5,5-diphenylimidazolidine-2,4-dione?
3-(2-oxobutyl)-5,5-diphenylimidazolidine-2,4-dione has a molecular weight of 322.36 g/mol, XLogP of 2.46, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-oxobutyl)-5,5-diphenylimidazolidine-2,4-dione is sourced from PubChem (CID 51108463), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).