2-(3-methyl-2,5-dioxoimidazolidin-1-yl)-N-(4-morpholin-4-ylphenyl)acetamide

C16H20N4O4 — CID 3979665

IUPAC2-(3-methyl-2,5-dioxoimidazolidin-1-yl)-N-(4-morpholin-4-ylphenyl)acetamide
SMILESCN1CC(=O)N(CC(=O)Nc2ccc(N3CCOCC3)cc2)C1=O
InChIInChI=1S/C16H20N4O4/c1-18-11-15(22)20(16(18)23)10-14(21)17-12-2-4-13(5-3-12)19-6-8-24-9-7-19/h2-5H,6-11H2,1H3,(H,17,21)
InChIKeyJUBBZPPNCQHHIK-UHFFFAOYSA-N
MW332.36 g/mol
LogP0.36
Rot. Bonds4

About 2-(3-methyl-2,5-dioxoimidazolidin-1-yl)-N-(4-morpholin-4-ylphenyl)acetamide

2-(3-methyl-2,5-dioxoimidazolidin-1-yl)-N-(4-morpholin-4-ylphenyl)acetamide (PubChem CID 3979665) has the molecular formula C16H20N4O4 and a molecular weight of 332.36 g/mol. Its IUPAC name is 2-(3-methyl-2,5-dioxoimidazolidin-1-yl)-N-(4-morpholin-4-ylphenyl)acetamide.

Molecular Properties

Compound Name2-(3-methyl-2,5-dioxoimidazolidin-1-yl)-N-(4-morpholin-4-ylphenyl)acetamide
PubChem CID3979665
Molecular FormulaC16H20N4O4
Molecular Weight332.36 g/mol
Exact Mass332.15
IUPAC Name2-(3-methyl-2,5-dioxoimidazolidin-1-yl)-N-(4-morpholin-4-ylphenyl)acetamide
SMILESCN1CC(=O)N(CC(=O)Nc2ccc(N3CCOCC3)cc2)C1=O
InChIInChI=1S/C16H20N4O4/c1-18-11-15(22)20(16(18)23)10-14(21)17-12-2-4-13(5-3-12)19-6-8-24-9-7-19/h2-5H,6-11H2,1H3,(H,17,21)
InChIKeyJUBBZPPNCQHHIK-UHFFFAOYSA-N
XLogP0.36
TPSA82.19 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.36
LogP ≤ 50.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_A(478)', 'substructure': 'N/A'}, {'alert_name': 'hydantoin', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-(3-methyl-2,5-dioxoimidazolidin-1-yl)-N-(4-morpholin-4-ylphenyl)acetamide?
The IUPAC name of 2-(3-methyl-2,5-dioxoimidazolidin-1-yl)-N-(4-morpholin-4-ylphenyl)acetamide (CID 3979665) is 2-(3-methyl-2,5-dioxoimidazolidin-1-yl)-N-(4-morpholin-4-ylphenyl)acetamide.
What is the SMILES notation for 2-(3-methyl-2,5-dioxoimidazolidin-1-yl)-N-(4-morpholin-4-ylphenyl)acetamide?
The canonical SMILES for 2-(3-methyl-2,5-dioxoimidazolidin-1-yl)-N-(4-morpholin-4-ylphenyl)acetamide is CN1CC(=O)N(CC(=O)Nc2ccc(N3CCOCC3)cc2)C1=O.
What is the InChIKey of 2-(3-methyl-2,5-dioxoimidazolidin-1-yl)-N-(4-morpholin-4-ylphenyl)acetamide?
The InChIKey is JUBBZPPNCQHHIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N4O4/c1-18-11-15(22)20(16(18)23)10-14(21)17-12-2-4-13(5-3-12)19-6-8-24-9-7-19/h2-5H,6-11H2,1H3,(H,17,21).
What are the key properties of 2-(3-methyl-2,5-dioxoimidazolidin-1-yl)-N-(4-morpholin-4-ylphenyl)acetamide?
2-(3-methyl-2,5-dioxoimidazolidin-1-yl)-N-(4-morpholin-4-ylphenyl)acetamide has a molecular weight of 332.36 g/mol, XLogP of 0.36, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methyl-2,5-dioxoimidazolidin-1-yl)-N-(4-morpholin-4-ylphenyl)acetamide is sourced from PubChem (CID 3979665), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).