3-[[2-(5,5-dimethyl-2,4-dioxoimidazolidin-1-yl)acetyl]amino]-N-ethyl-N-methylbenzamide

C17H22N4O4 — CID 136542546

IUPAC3-[[2-(5,5-dimethyl-2,4-dioxoimidazolidin-1-yl)acetyl]amino]-N-ethyl-N-methylbenzamide
SMILESCCN(C)C(=O)c1cccc(NC(=O)CN2C(=O)NC(=O)C2(C)C)c1
InChIInChI=1S/C17H22N4O4/c1-5-20(4)14(23)11-7-6-8-12(9-11)18-13(22)10-21-16(25)19-15(24)17(21,2)3/h6-9H,5,10H2,1-4H3,(H,18,22)(H,19,24,25)
InChIKeyKJHSZHNABQTQIT-UHFFFAOYSA-N
MW346.39 g/mol
LogP1.05
Rot. Bonds5

About 3-[[2-(5,5-dimethyl-2,4-dioxoimidazolidin-1-yl)acetyl]amino]-N-ethyl-N-methylbenzamide

3-[[2-(5,5-dimethyl-2,4-dioxoimidazolidin-1-yl)acetyl]amino]-N-ethyl-N-methylbenzamide (PubChem CID 136542546) has the molecular formula C17H22N4O4 and a molecular weight of 346.39 g/mol. Its IUPAC name is 3-[[2-(5,5-dimethyl-2,4-dioxoimidazolidin-1-yl)acetyl]amino]-N-ethyl-N-methylbenzamide.

Molecular Properties

Compound Name3-[[2-(5,5-dimethyl-2,4-dioxoimidazolidin-1-yl)acetyl]amino]-N-ethyl-N-methylbenzamide
PubChem CID136542546
Molecular FormulaC17H22N4O4
Molecular Weight346.39 g/mol
Exact Mass346.16
IUPAC Name3-[[2-(5,5-dimethyl-2,4-dioxoimidazolidin-1-yl)acetyl]amino]-N-ethyl-N-methylbenzamide
SMILESCCN(C)C(=O)c1cccc(NC(=O)CN2C(=O)NC(=O)C2(C)C)c1
InChIInChI=1S/C17H22N4O4/c1-5-20(4)14(23)11-7-6-8-12(9-11)18-13(22)10-21-16(25)19-15(24)17(21,2)3/h6-9H,5,10H2,1-4H3,(H,18,22)(H,19,24,25)
InChIKeyKJHSZHNABQTQIT-UHFFFAOYSA-N
XLogP1.05
TPSA98.82 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.39
LogP ≤ 51.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

3-(2,2-dimethylpropanoylamino)-N-ethyl-N-methylbenzamide
CID 134063370
N,N-dimethyl-3-[(2-pyrazol-1-ylacetyl)amino]benzamide
CID 33366231
3-acetamido-N-[2-(4-fluoroanilino)-2-oxoethyl]-N-methylbenzamide
CID 9441407
N-(3-acetylphenyl)-2-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)acetamide
CID 2547789
N,N'-bis[3-(dimethylcarbamoyl)phenyl]butanediamide
CID 17232267
N,N-diethyl-3-[[2-(4-ethylpiperazin-1-yl)acetyl]amino]benzamide
CID 32610918
3-[[2-[(1R,5S)-3-hydroxy-8-azabicyclo[3.2.1]octan-8-yl]acetyl]amino]-N,N-dimethylbenzamide
CID 166276577
N-benzyl-3-[[2-(N-ethylanilino)acetyl]amino]-N-methylbenzamide
CID 54808952
3-[[2-[(3S)-3-ethyl-3-methylmorpholin-4-yl]acetyl]amino]-N,N-dimethylbenzamide
CID 124846408
3-acetamido-N-methyl-N-(2-methylpropyl)benzamide
CID 47163271
methyl 3-[[ethyl(methyl)carbamoyl]amino]benzoate
CID 78916676
N,N-dimethyl-3-[[2-(propylamino)acetyl]amino]benzamide
CID 54819069

Frequently Asked Questions

What is the IUPAC name of 3-[[2-(5,5-dimethyl-2,4-dioxoimidazolidin-1-yl)acetyl]amino]-N-ethyl-N-methylbenzamide?
The IUPAC name of 3-[[2-(5,5-dimethyl-2,4-dioxoimidazolidin-1-yl)acetyl]amino]-N-ethyl-N-methylbenzamide (CID 136542546) is 3-[[2-(5,5-dimethyl-2,4-dioxoimidazolidin-1-yl)acetyl]amino]-N-ethyl-N-methylbenzamide.
What is the SMILES notation for 3-[[2-(5,5-dimethyl-2,4-dioxoimidazolidin-1-yl)acetyl]amino]-N-ethyl-N-methylbenzamide?
The canonical SMILES for 3-[[2-(5,5-dimethyl-2,4-dioxoimidazolidin-1-yl)acetyl]amino]-N-ethyl-N-methylbenzamide is CCN(C)C(=O)c1cccc(NC(=O)CN2C(=O)NC(=O)C2(C)C)c1.
What is the InChIKey of 3-[[2-(5,5-dimethyl-2,4-dioxoimidazolidin-1-yl)acetyl]amino]-N-ethyl-N-methylbenzamide?
The InChIKey is KJHSZHNABQTQIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N4O4/c1-5-20(4)14(23)11-7-6-8-12(9-11)18-13(22)10-21-16(25)19-15(24)17(21,2)3/h6-9H,5,10H2,1-4H3,(H,18,22)(H,19,24,25).
What are the key properties of 3-[[2-(5,5-dimethyl-2,4-dioxoimidazolidin-1-yl)acetyl]amino]-N-ethyl-N-methylbenzamide?
3-[[2-(5,5-dimethyl-2,4-dioxoimidazolidin-1-yl)acetyl]amino]-N-ethyl-N-methylbenzamide has a molecular weight of 346.39 g/mol, XLogP of 1.05, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[[2-(5,5-dimethyl-2,4-dioxoimidazolidin-1-yl)acetyl]amino]-N-ethyl-N-methylbenzamide is sourced from PubChem (CID 136542546), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).