2-(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)-N-[(E)-(4-fluorophenyl)methylideneamino]acetamide

C24H19FN4O3 — CID 127033116

IUPAC2-(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)-N-[(E)-(4-fluorophenyl)methylideneamino]acetamide
SMILESO=C(CN1C(=O)NC(c2ccccc2)(c2ccccc2)C1=O)N/N=C/c1ccc(F)cc1
InChIInChI=1S/C24H19FN4O3/c25-20-13-11-17(12-14-20)15-26-28-21(30)16-29-22(31)24(27-23(29)32,18-7-3-1-4-8-18)19-9-5-2-6-10-19/h1-15H,16H2,(H,27,32)(H,28,30)/b26-15+
InChIKeyZLANVPFVXVVODZ-CVKSISIWSA-N
MW430.44 g/mol
LogP2.77
Rot. Bonds6

About 2-(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)-N-[(E)-(4-fluorophenyl)methylideneamino]acetamide

2-(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)-N-[(E)-(4-fluorophenyl)methylideneamino]acetamide (PubChem CID 127033116) has the molecular formula C24H19FN4O3 and a molecular weight of 430.44 g/mol. Its IUPAC name is 2-(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)-N-[(E)-(4-fluorophenyl)methylideneamino]acetamide.

Molecular Properties

Compound Name2-(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)-N-[(E)-(4-fluorophenyl)methylideneamino]acetamide
PubChem CID127033116
Molecular FormulaC24H19FN4O3
Molecular Weight430.44 g/mol
Exact Mass430.14
IUPAC Name2-(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)-N-[(E)-(4-fluorophenyl)methylideneamino]acetamide
SMILESO=C(CN1C(=O)NC(c2ccccc2)(c2ccccc2)C1=O)N/N=C/c1ccc(F)cc1
InChIInChI=1S/C24H19FN4O3/c25-20-13-11-17(12-14-20)15-26-28-21(30)16-29-22(31)24(27-23(29)32,18-7-3-1-4-8-18)19-9-5-2-6-10-19/h1-15H,16H2,(H,27,32)(H,28,30)/b26-15+
InChIKeyZLANVPFVXVVODZ-CVKSISIWSA-N
XLogP2.77
TPSA90.87 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500430.44
LogP ≤ 52.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydantoin', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

2-(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)-N-[2-(4-fluorophenyl)ethyl]acetamide
CID 2087814
2-(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)-N-[(4-fluorophenyl)methyl]acetamide
CID 2103639
3-Benzyl-5,5-diphenylimidazolidine-2,4-dione
CID 2444465
N-benzyl-2-(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)acetamide
CID 2129006
2-fluoro-N'-[2-(4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl)acetyl]benzohydrazide
CID 25162375
N-(4-Fluorobenzyl)-2-((4-oxo-5,5-diphenyl-4,5-dihydro-1H-imidazol-2-yl)amino)acetamide
CID 135401389
N-benzyl-N-ethyl-2-[4-ethyl-4-(4-fluorophenyl)-2,5-dioxoimidazolidin-1-yl]acetamide
CID 5203298
N-benzyl-2-(4-benzyl-2,5-dioxo-4-phenylimidazolidin-1-yl)-N-propan-2-ylacetamide
CID 24820037
N'-[2-(4-ethyl-2,5-dioxo-4-phenylimidazolidin-1-yl)acetyl]-4-fluorobenzohydrazide
CID 25161998
5,5-Diphenyl-3-(2-phenylethyl)imidazolidine-2,4-dione
CID 44406745
2-(4-ethyl-2,5-dioxo-4-phenylimidazolidin-1-yl)-N-[(4-fluorophenyl)methyl]acetamide
CID 4810291
3-(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)-N-[(4-fluorophenyl)methyl]propanamide
CID 127031547

Frequently Asked Questions

What is the IUPAC name of 2-(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)-N-[(E)-(4-fluorophenyl)methylideneamino]acetamide?
The IUPAC name of 2-(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)-N-[(E)-(4-fluorophenyl)methylideneamino]acetamide (CID 127033116) is 2-(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)-N-[(E)-(4-fluorophenyl)methylideneamino]acetamide.
What is the SMILES notation for 2-(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)-N-[(E)-(4-fluorophenyl)methylideneamino]acetamide?
The canonical SMILES for 2-(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)-N-[(E)-(4-fluorophenyl)methylideneamino]acetamide is O=C(CN1C(=O)NC(c2ccccc2)(c2ccccc2)C1=O)N/N=C/c1ccc(F)cc1.
What is the InChIKey of 2-(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)-N-[(E)-(4-fluorophenyl)methylideneamino]acetamide?
The InChIKey is ZLANVPFVXVVODZ-CVKSISIWSA-N. The full InChI is InChI=1S/C24H19FN4O3/c25-20-13-11-17(12-14-20)15-26-28-21(30)16-29-22(31)24(27-23(29)32,18-7-3-1-4-8-18)19-9-5-2-6-10-19/h1-15H,16H2,(H,27,32)(H,28,30)/b26-15+.
What are the key properties of 2-(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)-N-[(E)-(4-fluorophenyl)methylideneamino]acetamide?
2-(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)-N-[(E)-(4-fluorophenyl)methylideneamino]acetamide has a molecular weight of 430.44 g/mol, XLogP of 2.77, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)-N-[(E)-(4-fluorophenyl)methylideneamino]acetamide is sourced from PubChem (CID 127033116), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).