2-(4-benzyl-2,5-dioxoimidazolidin-1-yl)-N-(2-fluorophenyl)acetamide

C18H16FN3O3 — CID 4796296

IUPAC2-(4-benzyl-2,5-dioxoimidazolidin-1-yl)-N-(2-fluorophenyl)acetamide
SMILESO=C(CN1C(=O)NC(Cc2ccccc2)C1=O)Nc1ccccc1F
InChIInChI=1S/C18H16FN3O3/c19-13-8-4-5-9-14(13)20-16(23)11-22-17(24)15(21-18(22)25)10-12-6-2-1-3-7-12/h1-9,15H,10-11H2,(H,20,23)(H,21,25)
InChIKeyJLWABFIPJFXVIH-UHFFFAOYSA-N
MW341.34 g/mol
LogP1.93
Rot. Bonds5

About 2-(4-benzyl-2,5-dioxoimidazolidin-1-yl)-N-(2-fluorophenyl)acetamide

2-(4-benzyl-2,5-dioxoimidazolidin-1-yl)-N-(2-fluorophenyl)acetamide (PubChem CID 4796296) has the molecular formula C18H16FN3O3 and a molecular weight of 341.34 g/mol. Its IUPAC name is 2-(4-benzyl-2,5-dioxoimidazolidin-1-yl)-N-(2-fluorophenyl)acetamide.

Molecular Properties

Compound Name2-(4-benzyl-2,5-dioxoimidazolidin-1-yl)-N-(2-fluorophenyl)acetamide
PubChem CID4796296
Molecular FormulaC18H16FN3O3
Molecular Weight341.34 g/mol
Exact Mass341.12
IUPAC Name2-(4-benzyl-2,5-dioxoimidazolidin-1-yl)-N-(2-fluorophenyl)acetamide
SMILESO=C(CN1C(=O)NC(Cc2ccccc2)C1=O)Nc1ccccc1F
InChIInChI=1S/C18H16FN3O3/c19-13-8-4-5-9-14(13)20-16(23)11-22-17(24)15(21-18(22)25)10-12-6-2-1-3-7-12/h1-9,15H,10-11H2,(H,20,23)(H,21,25)
InChIKeyJLWABFIPJFXVIH-UHFFFAOYSA-N
XLogP1.93
TPSA78.51 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.34
LogP ≤ 51.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

Spiperone
CID 5265
Aldumastat
CID 121448788
N,N'-((4-(dimethylamino)phenyl)methylene)bis(2-phenylacetamide)
CID 4296438
1,3,8-Triazaspiro(4.5)decan-4-one, 8-(4-(p-fluorophenyl)butyl)-1-phenyl-
CID 120580
3,4-Difluoro-N-{2-[1-(3-fluorophenyl)-4-oxo-1,3,8-triazaspiro[4.5]decan-8-YL]ethyl}benzamide
CID 53393916
Fluspiperone
CID 166535
Spiperone hydrochloride
CID 11957687
3-[(4-Fluorophenyl)methylamino]-1-phenylpyrrolidine-2,5-dione
CID 2877115
N-(3-ethylphenyl)-6-(5-methyl-2-oxoimidazolidin-4-yl)hexanamide
CID 4916632
N-(4-fluorophenyl)-6-(5-methyl-2-oxoimidazolidin-4-yl)hexanamide
CID 4916634
2-(2,5-dioxoimidazolidin-1-yl)-N-(p-tolyl)acetamide
CID 2162395
8-Benzyl-1-phenyl-1,3,8-triaza-spiro[4.5]decan-4-one
CID 70419

Frequently Asked Questions

What is the IUPAC name of 2-(4-benzyl-2,5-dioxoimidazolidin-1-yl)-N-(2-fluorophenyl)acetamide?
The IUPAC name of 2-(4-benzyl-2,5-dioxoimidazolidin-1-yl)-N-(2-fluorophenyl)acetamide (CID 4796296) is 2-(4-benzyl-2,5-dioxoimidazolidin-1-yl)-N-(2-fluorophenyl)acetamide.
What is the SMILES notation for 2-(4-benzyl-2,5-dioxoimidazolidin-1-yl)-N-(2-fluorophenyl)acetamide?
The canonical SMILES for 2-(4-benzyl-2,5-dioxoimidazolidin-1-yl)-N-(2-fluorophenyl)acetamide is O=C(CN1C(=O)NC(Cc2ccccc2)C1=O)Nc1ccccc1F.
What is the InChIKey of 2-(4-benzyl-2,5-dioxoimidazolidin-1-yl)-N-(2-fluorophenyl)acetamide?
The InChIKey is JLWABFIPJFXVIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16FN3O3/c19-13-8-4-5-9-14(13)20-16(23)11-22-17(24)15(21-18(22)25)10-12-6-2-1-3-7-12/h1-9,15H,10-11H2,(H,20,23)(H,21,25).
What are the key properties of 2-(4-benzyl-2,5-dioxoimidazolidin-1-yl)-N-(2-fluorophenyl)acetamide?
2-(4-benzyl-2,5-dioxoimidazolidin-1-yl)-N-(2-fluorophenyl)acetamide has a molecular weight of 341.34 g/mol, XLogP of 1.93, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-benzyl-2,5-dioxoimidazolidin-1-yl)-N-(2-fluorophenyl)acetamide is sourced from PubChem (CID 4796296), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).