2-(3-cyclopropyl-2,4,5-trioxoimidazolidin-1-yl)-N-(2-phenoxyphenyl)acetamide

C20H17N3O5 — CID 39920760

IUPAC2-(3-cyclopropyl-2,4,5-trioxoimidazolidin-1-yl)-N-(2-phenoxyphenyl)acetamide
SMILESO=C(CN1C(=O)C(=O)N(C2CC2)C1=O)Nc1ccccc1Oc1ccccc1
InChIInChI=1S/C20H17N3O5/c24-17(12-22-18(25)19(26)23(20(22)27)13-10-11-13)21-15-8-4-5-9-16(15)28-14-6-2-1-3-7-14/h1-9,13H,10-12H2,(H,21,24)
InChIKeyYNNXPDHHUADYAV-UHFFFAOYSA-N
MW379.37 g/mol
LogP2.37
Rot. Bonds6

About 2-(3-cyclopropyl-2,4,5-trioxoimidazolidin-1-yl)-N-(2-phenoxyphenyl)acetamide

2-(3-cyclopropyl-2,4,5-trioxoimidazolidin-1-yl)-N-(2-phenoxyphenyl)acetamide (PubChem CID 39920760) has the molecular formula C20H17N3O5 and a molecular weight of 379.37 g/mol. Its IUPAC name is 2-(3-cyclopropyl-2,4,5-trioxoimidazolidin-1-yl)-N-(2-phenoxyphenyl)acetamide.

Molecular Properties

Compound Name2-(3-cyclopropyl-2,4,5-trioxoimidazolidin-1-yl)-N-(2-phenoxyphenyl)acetamide
PubChem CID39920760
Molecular FormulaC20H17N3O5
Molecular Weight379.37 g/mol
Exact Mass379.12
IUPAC Name2-(3-cyclopropyl-2,4,5-trioxoimidazolidin-1-yl)-N-(2-phenoxyphenyl)acetamide
SMILESO=C(CN1C(=O)C(=O)N(C2CC2)C1=O)Nc1ccccc1Oc1ccccc1
InChIInChI=1S/C20H17N3O5/c24-17(12-22-18(25)19(26)23(20(22)27)13-10-11-13)21-15-8-4-5-9-16(15)28-14-6-2-1-3-7-14/h1-9,13H,10-12H2,(H,21,24)
InChIKeyYNNXPDHHUADYAV-UHFFFAOYSA-N
XLogP2.37
TPSA96.02 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500379.37
LogP ≤ 52.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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-(2-acetylphenyl)-2-(3-cyclopropyl-2,4,5-trioxoimidazolidin-1-yl)acetamide
CID 39920728
2-[(3aS,7aS)-1,3-dioxo-3a,4,7,7a-tetrahydroisoindol-2-yl]-N-(2-phenoxyphenyl)acetamide
CID 7952314
2-(3-methyl-2,5-dioxoimidazolidin-1-yl)-N-(2-phenoxyphenyl)acetamide
CID 8014768
N-(2-benzoylphenyl)-2-(3-cyclopentyl-2,4,5-trioxoimidazolidin-1-yl)acetamide
CID 7756202
2-(3-cyclopropyl-6-oxopyridazin-1-yl)-N-(2-phenoxyphenyl)acetamide
CID 122278540
N-[2-oxo-2-(2-phenoxyanilino)ethyl]cyclopropanecarboxamide
CID 42697207
2-(cyclopropylamino)-N-(2-phenoxyphenyl)acetamide
CID 60647217
2-[(3R)-3-methylpiperidin-1-yl]-N-(2-phenoxyphenyl)acetamide
CID 8903480
2-(3-cyclopentyl-2,4,5-trioxoimidazolidin-1-yl)-N-[4-(4-ethoxyphenoxy)phenyl]acetamide
CID 4880290
2-(3-cyclopropyl-2,4,5-trioxoimidazolidin-1-yl)-N-(3,4,5-trimethoxyphenyl)acetamide
CID 39920703
N-(2-phenoxyphenyl)-2-phenylacetamide
CID 1121260
2-[3-(hydroxymethyl)piperidin-1-yl]-N-(2-phenoxyphenyl)acetamide
CID 110877824

Frequently Asked Questions

What is the IUPAC name of 2-(3-cyclopropyl-2,4,5-trioxoimidazolidin-1-yl)-N-(2-phenoxyphenyl)acetamide?
The IUPAC name of 2-(3-cyclopropyl-2,4,5-trioxoimidazolidin-1-yl)-N-(2-phenoxyphenyl)acetamide (CID 39920760) is 2-(3-cyclopropyl-2,4,5-trioxoimidazolidin-1-yl)-N-(2-phenoxyphenyl)acetamide.
What is the SMILES notation for 2-(3-cyclopropyl-2,4,5-trioxoimidazolidin-1-yl)-N-(2-phenoxyphenyl)acetamide?
The canonical SMILES for 2-(3-cyclopropyl-2,4,5-trioxoimidazolidin-1-yl)-N-(2-phenoxyphenyl)acetamide is O=C(CN1C(=O)C(=O)N(C2CC2)C1=O)Nc1ccccc1Oc1ccccc1.
What is the InChIKey of 2-(3-cyclopropyl-2,4,5-trioxoimidazolidin-1-yl)-N-(2-phenoxyphenyl)acetamide?
The InChIKey is YNNXPDHHUADYAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17N3O5/c24-17(12-22-18(25)19(26)23(20(22)27)13-10-11-13)21-15-8-4-5-9-16(15)28-14-6-2-1-3-7-14/h1-9,13H,10-12H2,(H,21,24).
What are the key properties of 2-(3-cyclopropyl-2,4,5-trioxoimidazolidin-1-yl)-N-(2-phenoxyphenyl)acetamide?
2-(3-cyclopropyl-2,4,5-trioxoimidazolidin-1-yl)-N-(2-phenoxyphenyl)acetamide has a molecular weight of 379.37 g/mol, XLogP of 2.37, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-cyclopropyl-2,4,5-trioxoimidazolidin-1-yl)-N-(2-phenoxyphenyl)acetamide is sourced from PubChem (CID 39920760), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).