2-(2,5-dioxoimidazolidin-4-yl)-N-(2-methoxyphenyl)acetamide

C12H13N3O4 — CID 47150286

IUPAC2-(2,5-dioxoimidazolidin-4-yl)-N-(2-methoxyphenyl)acetamide
SMILESCOc1ccccc1NC(=O)CC1NC(=O)NC1=O
InChIInChI=1S/C12H13N3O4/c1-19-9-5-3-2-4-7(9)13-10(16)6-8-11(17)15-12(18)14-8/h2-5,8H,6H2,1H3,(H,13,16)(H2,14,15,17,18)
InChIKeyQIXRZLGZLDLGKH-UHFFFAOYSA-N
MW263.25 g/mol
LogP0.23
Rot. Bonds4

About 2-(2,5-dioxoimidazolidin-4-yl)-N-(2-methoxyphenyl)acetamide

2-(2,5-dioxoimidazolidin-4-yl)-N-(2-methoxyphenyl)acetamide (PubChem CID 47150286) has the molecular formula C12H13N3O4 and a molecular weight of 263.25 g/mol. Its IUPAC name is 2-(2,5-dioxoimidazolidin-4-yl)-N-(2-methoxyphenyl)acetamide.

Molecular Properties

Compound Name2-(2,5-dioxoimidazolidin-4-yl)-N-(2-methoxyphenyl)acetamide
PubChem CID47150286
Molecular FormulaC12H13N3O4
Molecular Weight263.25 g/mol
Exact Mass263.09
IUPAC Name2-(2,5-dioxoimidazolidin-4-yl)-N-(2-methoxyphenyl)acetamide
SMILESCOc1ccccc1NC(=O)CC1NC(=O)NC1=O
InChIInChI=1S/C12H13N3O4/c1-19-9-5-3-2-4-7(9)13-10(16)6-8-11(17)15-12(18)14-8/h2-5,8H,6H2,1H3,(H,13,16)(H2,14,15,17,18)
InChIKeyQIXRZLGZLDLGKH-UHFFFAOYSA-N
XLogP0.23
TPSA96.53 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.25
LogP ≤ 50.23
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-(2,5-dioxoimidazolidin-4-yl)-N-(2-methoxyphenyl)acetamide?
The IUPAC name of 2-(2,5-dioxoimidazolidin-4-yl)-N-(2-methoxyphenyl)acetamide (CID 47150286) is 2-(2,5-dioxoimidazolidin-4-yl)-N-(2-methoxyphenyl)acetamide.
What is the SMILES notation for 2-(2,5-dioxoimidazolidin-4-yl)-N-(2-methoxyphenyl)acetamide?
The canonical SMILES for 2-(2,5-dioxoimidazolidin-4-yl)-N-(2-methoxyphenyl)acetamide is COc1ccccc1NC(=O)CC1NC(=O)NC1=O.
What is the InChIKey of 2-(2,5-dioxoimidazolidin-4-yl)-N-(2-methoxyphenyl)acetamide?
The InChIKey is QIXRZLGZLDLGKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H13N3O4/c1-19-9-5-3-2-4-7(9)13-10(16)6-8-11(17)15-12(18)14-8/h2-5,8H,6H2,1H3,(H,13,16)(H2,14,15,17,18).
What are the key properties of 2-(2,5-dioxoimidazolidin-4-yl)-N-(2-methoxyphenyl)acetamide?
2-(2,5-dioxoimidazolidin-4-yl)-N-(2-methoxyphenyl)acetamide has a molecular weight of 263.25 g/mol, XLogP of 0.23, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,5-dioxoimidazolidin-4-yl)-N-(2-methoxyphenyl)acetamide is sourced from PubChem (CID 47150286), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).