N-(tert-butylcarbamoyl)-2-(3-methyl-2,4,5-trioxoimidazolidin-1-yl)acetamide

C11H16N4O5 — CID 7756730

IUPACN-(tert-butylcarbamoyl)-2-(3-methyl-2,4,5-trioxoimidazolidin-1-yl)acetamide
SMILESCN1C(=O)C(=O)N(CC(=O)NC(=O)NC(C)(C)C)C1=O
InChIInChI=1S/C11H16N4O5/c1-11(2,3)13-9(19)12-6(16)5-15-8(18)7(17)14(4)10(15)20/h5H2,1-4H3,(H2,12,13,16,19)
InChIKeyJHIQTMRWODMJGO-UHFFFAOYSA-N
MW284.27 g/mol
LogP-0.97
Rot. Bonds2

About N-(tert-butylcarbamoyl)-2-(3-methyl-2,4,5-trioxoimidazolidin-1-yl)acetamide

N-(tert-butylcarbamoyl)-2-(3-methyl-2,4,5-trioxoimidazolidin-1-yl)acetamide (PubChem CID 7756730) has the molecular formula C11H16N4O5 and a molecular weight of 284.27 g/mol. Its IUPAC name is N-(tert-butylcarbamoyl)-2-(3-methyl-2,4,5-trioxoimidazolidin-1-yl)acetamide.

Molecular Properties

Compound NameN-(tert-butylcarbamoyl)-2-(3-methyl-2,4,5-trioxoimidazolidin-1-yl)acetamide
PubChem CID7756730
Molecular FormulaC11H16N4O5
Molecular Weight284.27 g/mol
Exact Mass284.11
IUPAC NameN-(tert-butylcarbamoyl)-2-(3-methyl-2,4,5-trioxoimidazolidin-1-yl)acetamide
SMILESCN1C(=O)C(=O)N(CC(=O)NC(=O)NC(C)(C)C)C1=O
InChIInChI=1S/C11H16N4O5/c1-11(2,3)13-9(19)12-6(16)5-15-8(18)7(17)14(4)10(15)20/h5H2,1-4H3,(H2,12,13,16,19)
InChIKeyJHIQTMRWODMJGO-UHFFFAOYSA-N
XLogP-0.97
TPSA115.89 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.27
LogP ≤ 5-0.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze N-(tert-butylcarbamoyl)-2-(3-methyl-2,4,5-trioxoimidazolidin-1-yl)acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-[(3aR,7aR)-1,3-dioxo-3a,4,7,7a-tetrahydroisoindol-2-yl]-N-(tert-butylcarbamoyl)acetamide
CID 7952001
N-[(1R)-1-cyano-1-cyclopropylethyl]-2-(3-methyl-2,4,5-trioxoimidazolidin-1-yl)acetamide
CID 7756933
N-(tert-butylcarbamoyl)-2-(1,1,3-trioxo-1,2-benzothiazol-2-yl)acetamide
CID 2092208
2-(3-methyl-2,4,5-trioxoimidazolidin-1-yl)-N-(2,4,6-trimethylphenyl)acetamide
CID 7757167
N-[[(2S)-butan-2-yl]carbamoyl]-2-(3-ethyl-2,4,5-trioxoimidazolidin-1-yl)acetamide
CID 7824261
N-(tert-butylcarbamoyl)-2-hydroxyacetamide
CID 43558926
N-(tert-butylcarbamoyl)-2-[(4R)-4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl]acetamide
CID 2429434
N-(1-aminohexan-2-yl)-2-(3-methyl-2,4,5-trioxoimidazolidin-1-yl)acetamide;hydrochloride
CID 119668260
N-(2-fluoro-4-methylphenyl)-2-(3-methyl-2,4,5-trioxoimidazolidin-1-yl)acetamide
CID 7756792
N-[(1R,2S)-2-methylcyclohexyl]-2-(3-methyl-2,4,5-trioxoimidazolidin-1-yl)acetamide
CID 7756880
N-(tert-butylcarbamoyl)-2-[4-(hydroxymethyl)triazol-1-yl]acetamide
CID 55067228
2-(3-ethyl-2,4,5-trioxoimidazolidin-1-yl)-N-(2-methylbutan-2-yl)acetamide
CID 34718348

Frequently Asked Questions

What is the IUPAC name of N-(tert-butylcarbamoyl)-2-(3-methyl-2,4,5-trioxoimidazolidin-1-yl)acetamide?
The IUPAC name of N-(tert-butylcarbamoyl)-2-(3-methyl-2,4,5-trioxoimidazolidin-1-yl)acetamide (CID 7756730) is N-(tert-butylcarbamoyl)-2-(3-methyl-2,4,5-trioxoimidazolidin-1-yl)acetamide.
What is the SMILES notation for N-(tert-butylcarbamoyl)-2-(3-methyl-2,4,5-trioxoimidazolidin-1-yl)acetamide?
The canonical SMILES for N-(tert-butylcarbamoyl)-2-(3-methyl-2,4,5-trioxoimidazolidin-1-yl)acetamide is CN1C(=O)C(=O)N(CC(=O)NC(=O)NC(C)(C)C)C1=O.
What is the InChIKey of N-(tert-butylcarbamoyl)-2-(3-methyl-2,4,5-trioxoimidazolidin-1-yl)acetamide?
The InChIKey is JHIQTMRWODMJGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N4O5/c1-11(2,3)13-9(19)12-6(16)5-15-8(18)7(17)14(4)10(15)20/h5H2,1-4H3,(H2,12,13,16,19).
What are the key properties of N-(tert-butylcarbamoyl)-2-(3-methyl-2,4,5-trioxoimidazolidin-1-yl)acetamide?
N-(tert-butylcarbamoyl)-2-(3-methyl-2,4,5-trioxoimidazolidin-1-yl)acetamide has a molecular weight of 284.27 g/mol, XLogP of -0.97, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(tert-butylcarbamoyl)-2-(3-methyl-2,4,5-trioxoimidazolidin-1-yl)acetamide is sourced from PubChem (CID 7756730), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).