3-(1-benzyl-2,5-dioxoimidazolidin-4-yl)-N-(4-phenoxyphenyl)propanamide

C25H23N3O4 — CID 73259731

IUPAC3-(1-benzyl-2,5-dioxoimidazolidin-4-yl)-N-(4-phenoxyphenyl)propanamide
SMILESO=C(CCC1NC(=O)N(Cc2ccccc2)C1=O)Nc1ccc(Oc2ccccc2)cc1
InChIInChI=1S/C25H23N3O4/c29-23(26-19-11-13-21(14-12-19)32-20-9-5-2-6-10-20)16-15-22-24(30)28(25(31)27-22)17-18-7-3-1-4-8-18/h1-14,22H,15-17H2,(H,26,29)(H,27,31)
InChIKeyUJBGFXYKMAMHOH-UHFFFAOYSA-N
MW429.48 g/mol
LogP4.32
Rot. Bonds8

About 3-(1-benzyl-2,5-dioxoimidazolidin-4-yl)-N-(4-phenoxyphenyl)propanamide

3-(1-benzyl-2,5-dioxoimidazolidin-4-yl)-N-(4-phenoxyphenyl)propanamide (PubChem CID 73259731) has the molecular formula C25H23N3O4 and a molecular weight of 429.48 g/mol. Its IUPAC name is 3-(1-benzyl-2,5-dioxoimidazolidin-4-yl)-N-(4-phenoxyphenyl)propanamide.

Molecular Properties

Compound Name3-(1-benzyl-2,5-dioxoimidazolidin-4-yl)-N-(4-phenoxyphenyl)propanamide
PubChem CID73259731
Molecular FormulaC25H23N3O4
Molecular Weight429.48 g/mol
Exact Mass429.17
IUPAC Name3-(1-benzyl-2,5-dioxoimidazolidin-4-yl)-N-(4-phenoxyphenyl)propanamide
SMILESO=C(CCC1NC(=O)N(Cc2ccccc2)C1=O)Nc1ccc(Oc2ccccc2)cc1
InChIInChI=1S/C25H23N3O4/c29-23(26-19-11-13-21(14-12-19)32-20-9-5-2-6-10-20)16-15-22-24(30)28(25(31)27-22)17-18-7-3-1-4-8-18/h1-14,22H,15-17H2,(H,26,29)(H,27,31)
InChIKeyUJBGFXYKMAMHOH-UHFFFAOYSA-N
XLogP4.32
TPSA87.74 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500429.48
LogP ≤ 54.32
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

2-(2,5-dioxo-4-propylimidazolidin-1-yl)-N-(4-phenoxyphenyl)acetamide
CID 17465722
3-[(4R)-2,5-dioxo-1-[(1R)-1-phenylethyl]imidazolidin-4-yl]-N-(4-phenoxyphenyl)propanamide
CID 51836598
N-(5-acetamido-2-methoxyphenyl)-3-[(4S)-1-benzyl-2,5-dioxoimidazolidin-4-yl]propanamide
CID 91638918
3-[(4R)-1-(1,3-benzodioxol-5-ylmethyl)-2,5-dioxoimidazolidin-4-yl]-N-phenylpropanamide
CID 51842365
N-(2-ethylphenyl)-3-[(4R)-1-[(4-methoxyphenyl)methyl]-2,5-dioxoimidazolidin-4-yl]propanamide
CID 51842022
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-3-[(4R)-1-[(4-methoxyphenyl)methyl]-2,5-dioxoimidazolidin-4-yl]propanamide
CID 51829737
3-(1-benzyl-2,5-dioxoimidazolidin-4-yl)-N-[3-(1H-1,2,4-triazol-5-yl)phenyl]propanamide
CID 91822742
2-[(4S)-2,5-dioxo-4-(2-phenylethyl)imidazolidin-1-yl]-N-(4-methoxyphenyl)acetamide
CID 2598211
3-[(4R)-1-benzyl-2,5-dioxoimidazolidin-4-yl]-N-(3-methoxypropyl)propanamide
CID 51837195
N-(4-methoxyphenyl)-2-[(4R)-1-[(4-methoxyphenyl)methyl]-2,5-dioxoimidazolidin-4-yl]acetamide
CID 99871007
N-[(3-methoxyphenyl)methyl]-3-[1-[(4-methoxyphenyl)methyl]-2,5-dioxoimidazolidin-4-yl]propanamide
CID 73258308
3-(1-benzyl-2,5-dioxoimidazolidin-4-yl)-N-[5-(2-phenylethyl)-1H-1,2,4-triazol-3-yl]propanamide
CID 91821927

Frequently Asked Questions

What is the IUPAC name of 3-(1-benzyl-2,5-dioxoimidazolidin-4-yl)-N-(4-phenoxyphenyl)propanamide?
The IUPAC name of 3-(1-benzyl-2,5-dioxoimidazolidin-4-yl)-N-(4-phenoxyphenyl)propanamide (CID 73259731) is 3-(1-benzyl-2,5-dioxoimidazolidin-4-yl)-N-(4-phenoxyphenyl)propanamide.
What is the SMILES notation for 3-(1-benzyl-2,5-dioxoimidazolidin-4-yl)-N-(4-phenoxyphenyl)propanamide?
The canonical SMILES for 3-(1-benzyl-2,5-dioxoimidazolidin-4-yl)-N-(4-phenoxyphenyl)propanamide is O=C(CCC1NC(=O)N(Cc2ccccc2)C1=O)Nc1ccc(Oc2ccccc2)cc1.
What is the InChIKey of 3-(1-benzyl-2,5-dioxoimidazolidin-4-yl)-N-(4-phenoxyphenyl)propanamide?
The InChIKey is UJBGFXYKMAMHOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H23N3O4/c29-23(26-19-11-13-21(14-12-19)32-20-9-5-2-6-10-20)16-15-22-24(30)28(25(31)27-22)17-18-7-3-1-4-8-18/h1-14,22H,15-17H2,(H,26,29)(H,27,31).
What are the key properties of 3-(1-benzyl-2,5-dioxoimidazolidin-4-yl)-N-(4-phenoxyphenyl)propanamide?
3-(1-benzyl-2,5-dioxoimidazolidin-4-yl)-N-(4-phenoxyphenyl)propanamide has a molecular weight of 429.48 g/mol, XLogP of 4.32, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-benzyl-2,5-dioxoimidazolidin-4-yl)-N-(4-phenoxyphenyl)propanamide is sourced from PubChem (CID 73259731), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).