N-(5-acetamido-2-methoxyphenyl)-2-(3-ethyl-2,4,5-trioxoimidazolidin-1-yl)acetamide

C16H18N4O6 — CID 9342184

IUPACN-(5-acetamido-2-methoxyphenyl)-2-(3-ethyl-2,4,5-trioxoimidazolidin-1-yl)acetamide
SMILESCCN1C(=O)C(=O)N(CC(=O)Nc2cc(NC(C)=O)ccc2OC)C1=O
InChIInChI=1S/C16H18N4O6/c1-4-19-14(23)15(24)20(16(19)25)8-13(22)18-11-7-10(17-9(2)21)5-6-12(11)26-3/h5-7H,4,8H2,1-3H3,(H,17,21)(H,18,22)
InChIKeyLPRNTJAMYSNBEW-UHFFFAOYSA-N
MW362.34 g/mol
LogP0.40
Rot. Bonds6

About N-(5-acetamido-2-methoxyphenyl)-2-(3-ethyl-2,4,5-trioxoimidazolidin-1-yl)acetamide

N-(5-acetamido-2-methoxyphenyl)-2-(3-ethyl-2,4,5-trioxoimidazolidin-1-yl)acetamide (PubChem CID 9342184) has the molecular formula C16H18N4O6 and a molecular weight of 362.34 g/mol. Its IUPAC name is N-(5-acetamido-2-methoxyphenyl)-2-(3-ethyl-2,4,5-trioxoimidazolidin-1-yl)acetamide.

Molecular Properties

Compound NameN-(5-acetamido-2-methoxyphenyl)-2-(3-ethyl-2,4,5-trioxoimidazolidin-1-yl)acetamide
PubChem CID9342184
Molecular FormulaC16H18N4O6
Molecular Weight362.34 g/mol
Exact Mass362.12
IUPAC NameN-(5-acetamido-2-methoxyphenyl)-2-(3-ethyl-2,4,5-trioxoimidazolidin-1-yl)acetamide
SMILESCCN1C(=O)C(=O)N(CC(=O)Nc2cc(NC(C)=O)ccc2OC)C1=O
InChIInChI=1S/C16H18N4O6/c1-4-19-14(23)15(24)20(16(19)25)8-13(22)18-11-7-10(17-9(2)21)5-6-12(11)26-3/h5-7H,4,8H2,1-3H3,(H,17,21)(H,18,22)
InChIKeyLPRNTJAMYSNBEW-UHFFFAOYSA-N
XLogP0.40
TPSA125.12 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.34
LogP ≤ 50.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

N-(5-acetamido-2-methoxyphenyl)-2-[3-(2-methylpropyl)-2,4,5-trioxoimidazolidin-1-yl]acetamide
CID 8889133
N-(5-acetamido-2-methoxyphenyl)-2-(azocan-1-yl)acetamide
CID 8680244
N-(5-acetamido-2-methoxyphenyl)-3-chloropropanamide
CID 43236542
2-(3-ethyl-2,4,5-trioxoimidazolidin-1-yl)-N-(2,4,5-trichlorophenyl)acetamide
CID 7824204
N-(5-chloro-2-methoxyphenyl)-2-(2,4,5-trioxo-3-prop-2-enylimidazolidin-1-yl)acetamide
CID 51139615
N-(5-acetamido-2-methoxyphenyl)-2-(1-methyl-3,4-dihydro-1H-pyrrolo[1,2-a]pyrazin-2-yl)acetamide
CID 17445310
[2-(5-acetamido-2-methoxyanilino)-2-oxoethyl] propanoate
CID 9015180
3-[(3aS,7aS)-1,3-dioxo-3a,4,5,6,7,7a-hexahydroisoindol-2-yl]-N-(5-acetamido-2-methoxyphenyl)propanamide
CID 2641877
N-(5-acetamido-2-methoxyphenyl)-2-(4-methylphenyl)acetamide
CID 17432370
N-(5-acetamido-2-methoxyphenyl)-2-thiophen-3-ylacetamide
CID 17419618
N-(5-acetamido-2-methoxyphenyl)-2-(cyclopropylmethylamino)acetamide;hydrochloride
CID 119680223
N-(5-acetamido-2-methoxyphenyl)-2-(2-methylindol-1-yl)acetamide
CID 17419691

Frequently Asked Questions

What is the IUPAC name of N-(5-acetamido-2-methoxyphenyl)-2-(3-ethyl-2,4,5-trioxoimidazolidin-1-yl)acetamide?
The IUPAC name of N-(5-acetamido-2-methoxyphenyl)-2-(3-ethyl-2,4,5-trioxoimidazolidin-1-yl)acetamide (CID 9342184) is N-(5-acetamido-2-methoxyphenyl)-2-(3-ethyl-2,4,5-trioxoimidazolidin-1-yl)acetamide.
What is the SMILES notation for N-(5-acetamido-2-methoxyphenyl)-2-(3-ethyl-2,4,5-trioxoimidazolidin-1-yl)acetamide?
The canonical SMILES for N-(5-acetamido-2-methoxyphenyl)-2-(3-ethyl-2,4,5-trioxoimidazolidin-1-yl)acetamide is CCN1C(=O)C(=O)N(CC(=O)Nc2cc(NC(C)=O)ccc2OC)C1=O.
What is the InChIKey of N-(5-acetamido-2-methoxyphenyl)-2-(3-ethyl-2,4,5-trioxoimidazolidin-1-yl)acetamide?
The InChIKey is LPRNTJAMYSNBEW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N4O6/c1-4-19-14(23)15(24)20(16(19)25)8-13(22)18-11-7-10(17-9(2)21)5-6-12(11)26-3/h5-7H,4,8H2,1-3H3,(H,17,21)(H,18,22).
What are the key properties of N-(5-acetamido-2-methoxyphenyl)-2-(3-ethyl-2,4,5-trioxoimidazolidin-1-yl)acetamide?
N-(5-acetamido-2-methoxyphenyl)-2-(3-ethyl-2,4,5-trioxoimidazolidin-1-yl)acetamide has a molecular weight of 362.34 g/mol, XLogP of 0.40, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-acetamido-2-methoxyphenyl)-2-(3-ethyl-2,4,5-trioxoimidazolidin-1-yl)acetamide is sourced from PubChem (CID 9342184), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).