2-(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)-N-(6-methylheptan-2-yl)acetamide

C25H31N3O3 — CID 46606290

IUPAC2-(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)-N-(6-methylheptan-2-yl)acetamide
SMILESCC(C)CCCC(C)NC(=O)CN1C(=O)NC(c2ccccc2)(c2ccccc2)C1=O
InChIInChI=1S/C25H31N3O3/c1-18(2)11-10-12-19(3)26-22(29)17-28-23(30)25(27-24(28)31,20-13-6-4-7-14-20)21-15-8-5-9-16-21/h4-9,13-16,18-19H,10-12,17H2,1-3H3,(H,26,29)(H,27,31)
InChIKeyHODPTECBIADOJL-UHFFFAOYSA-N
MW421.54 g/mol
LogP3.81
Rot. Bonds9

About 2-(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)-N-(6-methylheptan-2-yl)acetamide

2-(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)-N-(6-methylheptan-2-yl)acetamide (PubChem CID 46606290) has the molecular formula C25H31N3O3 and a molecular weight of 421.54 g/mol. Its IUPAC name is 2-(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)-N-(6-methylheptan-2-yl)acetamide.

Molecular Properties

Compound Name2-(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)-N-(6-methylheptan-2-yl)acetamide
PubChem CID46606290
Molecular FormulaC25H31N3O3
Molecular Weight421.54 g/mol
Exact Mass421.24
IUPAC Name2-(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)-N-(6-methylheptan-2-yl)acetamide
SMILESCC(C)CCCC(C)NC(=O)CN1C(=O)NC(c2ccccc2)(c2ccccc2)C1=O
InChIInChI=1S/C25H31N3O3/c1-18(2)11-10-12-19(3)26-22(29)17-28-23(30)25(27-24(28)31,20-13-6-4-7-14-20)21-15-8-5-9-16-21/h4-9,13-16,18-19H,10-12,17H2,1-3H3,(H,26,29)(H,27,31)
InChIKeyHODPTECBIADOJL-UHFFFAOYSA-N
XLogP3.81
TPSA78.51 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500421.54
LogP ≤ 53.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-[(1R)-1-(4-bromophenyl)ethyl]-2-(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)acetamide
CID 41079592
2-[(4R)-2,5-dioxo-4-phenyl-4-propylimidazolidin-1-yl]-N-[(2R)-5-methylhexan-2-yl]acetamide
CID 8572588
2-[(4R)-4-ethyl-4-(4-fluorophenyl)-2,5-dioxoimidazolidin-1-yl]-N-[(2R)-6-methylheptan-2-yl]acetamide
CID 8571329
2-[(4R)-4-ethyl-2,5-dioxo-4-phenylimidazolidin-1-yl]-N-[(2R)-pentan-2-yl]acetamide
CID 8849641
2-(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)-N-[(S)-phenyl(thiophen-2-yl)methyl]acetamide
CID 41138688
2-[4,4-bis(4-methoxyphenyl)-2,5-dioxoimidazolidin-1-yl]-N-[(2R)-butan-2-yl]acetamide
CID 51448091
N-[(2R)-5-methylhexan-2-yl]-2-[(4R)-4-methyl-4-naphthalen-2-yl-2,5-dioxoimidazolidin-1-yl]acetamide
CID 40748919
N-(3-methylbutan-2-yl)-2-[4-(2-methylpropyl)-2,5-dioxo-4-phenylimidazolidin-1-yl]acetamide
CID 42989141
2-(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)-N-(4-methylphenyl)acetamide
CID 84601269
3-(2-oxobutyl)-5,5-diphenylimidazolidine-2,4-dione
CID 51108463
2-[(4R)-4-methyl-2,5-dioxo-4-(4-propan-2-ylphenyl)imidazolidin-1-yl]-N-[(2S)-5-methylhexan-2-yl]acetamide
CID 8625506
N-(2-bromophenyl)-2-(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)acetamide
CID 4045289

Frequently Asked Questions

What is the IUPAC name of 2-(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)-N-(6-methylheptan-2-yl)acetamide?
The IUPAC name of 2-(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)-N-(6-methylheptan-2-yl)acetamide (CID 46606290) is 2-(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)-N-(6-methylheptan-2-yl)acetamide.
What is the SMILES notation for 2-(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)-N-(6-methylheptan-2-yl)acetamide?
The canonical SMILES for 2-(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)-N-(6-methylheptan-2-yl)acetamide is CC(C)CCCC(C)NC(=O)CN1C(=O)NC(c2ccccc2)(c2ccccc2)C1=O.
What is the InChIKey of 2-(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)-N-(6-methylheptan-2-yl)acetamide?
The InChIKey is HODPTECBIADOJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H31N3O3/c1-18(2)11-10-12-19(3)26-22(29)17-28-23(30)25(27-24(28)31,20-13-6-4-7-14-20)21-15-8-5-9-16-21/h4-9,13-16,18-19H,10-12,17H2,1-3H3,(H,26,29)(H,27,31).
What are the key properties of 2-(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)-N-(6-methylheptan-2-yl)acetamide?
2-(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)-N-(6-methylheptan-2-yl)acetamide has a molecular weight of 421.54 g/mol, XLogP of 3.81, 9 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)-N-(6-methylheptan-2-yl)acetamide is sourced from PubChem (CID 46606290), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).