2-[4-(4-fluorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-[(3-phenylmethoxyphenyl)methyl]acetamide

C26H24FN3O4 — CID 55846406

IUPAC2-[4-(4-fluorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-[(3-phenylmethoxyphenyl)methyl]acetamide
SMILESCC1(c2ccc(F)cc2)NC(=O)N(CC(=O)NCc2cccc(OCc3ccccc3)c2)C1=O
InChIInChI=1S/C26H24FN3O4/c1-26(20-10-12-21(27)13-11-20)24(32)30(25(33)29-26)16-23(31)28-15-19-8-5-9-22(14-19)34-17-18-6-3-2-4-7-18/h2-14H,15-17H2,1H3,(H,28,31)(H,29,33)
InChIKeyPEIZQDMRYVBQAM-UHFFFAOYSA-N
MW461.49 g/mol
LogP3.49
Rot. Bonds8

About 2-[4-(4-fluorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-[(3-phenylmethoxyphenyl)methyl]acetamide

2-[4-(4-fluorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-[(3-phenylmethoxyphenyl)methyl]acetamide (PubChem CID 55846406) has the molecular formula C26H24FN3O4 and a molecular weight of 461.49 g/mol. Its IUPAC name is 2-[4-(4-fluorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-[(3-phenylmethoxyphenyl)methyl]acetamide.

Molecular Properties

Compound Name2-[4-(4-fluorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-[(3-phenylmethoxyphenyl)methyl]acetamide
PubChem CID55846406
Molecular FormulaC26H24FN3O4
Molecular Weight461.49 g/mol
Exact Mass461.18
IUPAC Name2-[4-(4-fluorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-[(3-phenylmethoxyphenyl)methyl]acetamide
SMILESCC1(c2ccc(F)cc2)NC(=O)N(CC(=O)NCc2cccc(OCc3ccccc3)c2)C1=O
InChIInChI=1S/C26H24FN3O4/c1-26(20-10-12-21(27)13-11-20)24(32)30(25(33)29-26)16-23(31)28-15-19-8-5-9-22(14-19)34-17-18-6-3-2-4-7-18/h2-14H,15-17H2,1H3,(H,28,31)(H,29,33)
InChIKeyPEIZQDMRYVBQAM-UHFFFAOYSA-N
XLogP3.49
TPSA87.74 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms34
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500461.49
LogP ≤ 53.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-benzyl-2-[(4R)-4-(4-fluorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetamide
CID 40873139
2-[4-(4-fluorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-(2-phenoxyethyl)acetamide
CID 18099224
2-[(4S)-4-(4-fluorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-(pyridin-3-ylmethyl)acetamide
CID 31334048
5-methyl-5-phenyl-3-[(3-phenylmethoxyphenyl)methyl]imidazolidine-2,4-dione
CID 60603827
N-[(4-fluorophenyl)methyl]-2-(4-methyl-4-naphthalen-2-yl-2,5-dioxoimidazolidin-1-yl)acetamide
CID 16546321
N-[(3-bromophenyl)methyl]-2-[4-(4-methoxyphenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetamide
CID 55576899
N-[(3-methoxyphenyl)methyl]-2-[(4R)-4-methyl-4-naphthalen-1-yl-2,5-dioxoimidazolidin-1-yl]acetamide
CID 7242813
2-[(4S)-4-(4-cyanophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-[(3-methoxy-4-phenylmethoxyphenyl)methyl]acetamide
CID 31609262
N-benzyl-2-[4-(4-cyanophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetamide
CID 51138694
[2-[(4-fluorophenyl)methylamino]-2-oxoethyl] 2-[(4S)-4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl]acetate
CID 7685076
2-[4-methyl-4-(4-methylphenyl)-2,5-dioxoimidazolidin-1-yl]-N-[[2-(phenylmethoxymethyl)phenyl]methyl]acetamide
CID 46456306
N-[(3-chlorophenyl)methyl]-2-[4-(2,5-difluorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetamide
CID 55374728

Frequently Asked Questions

What is the IUPAC name of 2-[4-(4-fluorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-[(3-phenylmethoxyphenyl)methyl]acetamide?
The IUPAC name of 2-[4-(4-fluorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-[(3-phenylmethoxyphenyl)methyl]acetamide (CID 55846406) is 2-[4-(4-fluorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-[(3-phenylmethoxyphenyl)methyl]acetamide.
What is the SMILES notation for 2-[4-(4-fluorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-[(3-phenylmethoxyphenyl)methyl]acetamide?
The canonical SMILES for 2-[4-(4-fluorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-[(3-phenylmethoxyphenyl)methyl]acetamide is CC1(c2ccc(F)cc2)NC(=O)N(CC(=O)NCc2cccc(OCc3ccccc3)c2)C1=O.
What is the InChIKey of 2-[4-(4-fluorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-[(3-phenylmethoxyphenyl)methyl]acetamide?
The InChIKey is PEIZQDMRYVBQAM-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H24FN3O4/c1-26(20-10-12-21(27)13-11-20)24(32)30(25(33)29-26)16-23(31)28-15-19-8-5-9-22(14-19)34-17-18-6-3-2-4-7-18/h2-14H,15-17H2,1H3,(H,28,31)(H,29,33).
What are the key properties of 2-[4-(4-fluorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-[(3-phenylmethoxyphenyl)methyl]acetamide?
2-[4-(4-fluorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-[(3-phenylmethoxyphenyl)methyl]acetamide has a molecular weight of 461.49 g/mol, XLogP of 3.49, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(4-fluorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-[(3-phenylmethoxyphenyl)methyl]acetamide is sourced from PubChem (CID 55846406), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).