2-(2,5-dioxo-4-phenyl-4-propylimidazolidin-1-yl)-N-(4-phenoxyphenyl)acetamide

C26H25N3O4 — CID 4081516

IUPAC2-(2,5-dioxo-4-phenyl-4-propylimidazolidin-1-yl)-N-(4-phenoxyphenyl)acetamide
SMILESCCCC1(c2ccccc2)NC(=O)N(CC(=O)Nc2ccc(Oc3ccccc3)cc2)C1=O
InChIInChI=1S/C26H25N3O4/c1-2-17-26(19-9-5-3-6-10-19)24(31)29(25(32)28-26)18-23(30)27-20-13-15-22(16-14-20)33-21-11-7-4-8-12-21/h3-16H,2,17-18H2,1H3,(H,27,30)(H,28,32)
InChIKeyKTBQRWWANPXTFW-UHFFFAOYSA-N
MW443.50 g/mol
LogP4.66
Rot. Bonds8

About 2-(2,5-dioxo-4-phenyl-4-propylimidazolidin-1-yl)-N-(4-phenoxyphenyl)acetamide

2-(2,5-dioxo-4-phenyl-4-propylimidazolidin-1-yl)-N-(4-phenoxyphenyl)acetamide (PubChem CID 4081516) has the molecular formula C26H25N3O4 and a molecular weight of 443.50 g/mol. Its IUPAC name is 2-(2,5-dioxo-4-phenyl-4-propylimidazolidin-1-yl)-N-(4-phenoxyphenyl)acetamide.

Molecular Properties

Compound Name2-(2,5-dioxo-4-phenyl-4-propylimidazolidin-1-yl)-N-(4-phenoxyphenyl)acetamide
PubChem CID4081516
Molecular FormulaC26H25N3O4
Molecular Weight443.50 g/mol
Exact Mass443.18
IUPAC Name2-(2,5-dioxo-4-phenyl-4-propylimidazolidin-1-yl)-N-(4-phenoxyphenyl)acetamide
SMILESCCCC1(c2ccccc2)NC(=O)N(CC(=O)Nc2ccc(Oc3ccccc3)cc2)C1=O
InChIInChI=1S/C26H25N3O4/c1-2-17-26(19-9-5-3-6-10-19)24(31)29(25(32)28-26)18-23(30)27-20-13-15-22(16-14-20)33-21-11-7-4-8-12-21/h3-16H,2,17-18H2,1H3,(H,27,30)(H,28,32)
InChIKeyKTBQRWWANPXTFW-UHFFFAOYSA-N
XLogP4.66
TPSA87.74 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500443.50
LogP ≤ 54.66
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-[(4S)-2,5-dioxo-4-phenyl-4-propylimidazolidin-1-yl]-N-(4-fluorophenyl)acetamide
CID 2082745
2-[(4R)-2,5-dioxo-4-phenyl-4-propylimidazolidin-1-yl]-N-[4-(trifluoromethoxy)phenyl]acetamide
CID 2089932
2-[(4R)-2,5-dioxo-4-phenyl-4-propylimidazolidin-1-yl]-N-(4-ethylphenyl)acetamide
CID 2585532
2-(2,5-dioxo-4-phenyl-4-propylimidazolidin-1-yl)-N-(4-methylsulfanylphenyl)acetamide
CID 24566026
2-[(4R)-4-butyl-2,5-dioxo-4-phenylimidazolidin-1-yl]-N-[4-(difluoromethoxy)phenyl]acetamide
CID 41123926
2-(2,5-dioxo-4,4-diphenylimidazolidin-1-yl)-N-(4-phenoxyphenyl)acetamide
CID 42964494
2-[(4R)-2,5-dioxo-4-phenyl-4-propylimidazolidin-1-yl]-N-(4-morpholin-4-ylphenyl)acetamide
CID 41114565
2-(2,5-dioxo-4-phenyl-4-propylimidazolidin-1-yl)-N-[4-[ethyl(propan-2-yl)amino]phenyl]acetamide
CID 24683758
N-(3-acetylphenyl)-2-[(4R)-2,5-dioxo-4-phenyl-4-propylimidazolidin-1-yl]acetamide
CID 2703685
2-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-(4-phenoxyphenyl)acetamide
CID 7269459
2-(4-ethyl-4-methyl-2,5-dioxoimidazolidin-1-yl)-N-(4-phenoxyphenyl)acetamide
CID 17445056
N-(3-chlorophenyl)-2-[(4R)-2,5-dioxo-4-phenyl-4-propylimidazolidin-1-yl]acetamide
CID 2585526

Frequently Asked Questions

What is the IUPAC name of 2-(2,5-dioxo-4-phenyl-4-propylimidazolidin-1-yl)-N-(4-phenoxyphenyl)acetamide?
The IUPAC name of 2-(2,5-dioxo-4-phenyl-4-propylimidazolidin-1-yl)-N-(4-phenoxyphenyl)acetamide (CID 4081516) is 2-(2,5-dioxo-4-phenyl-4-propylimidazolidin-1-yl)-N-(4-phenoxyphenyl)acetamide.
What is the SMILES notation for 2-(2,5-dioxo-4-phenyl-4-propylimidazolidin-1-yl)-N-(4-phenoxyphenyl)acetamide?
The canonical SMILES for 2-(2,5-dioxo-4-phenyl-4-propylimidazolidin-1-yl)-N-(4-phenoxyphenyl)acetamide is CCCC1(c2ccccc2)NC(=O)N(CC(=O)Nc2ccc(Oc3ccccc3)cc2)C1=O.
What is the InChIKey of 2-(2,5-dioxo-4-phenyl-4-propylimidazolidin-1-yl)-N-(4-phenoxyphenyl)acetamide?
The InChIKey is KTBQRWWANPXTFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H25N3O4/c1-2-17-26(19-9-5-3-6-10-19)24(31)29(25(32)28-26)18-23(30)27-20-13-15-22(16-14-20)33-21-11-7-4-8-12-21/h3-16H,2,17-18H2,1H3,(H,27,30)(H,28,32).
What are the key properties of 2-(2,5-dioxo-4-phenyl-4-propylimidazolidin-1-yl)-N-(4-phenoxyphenyl)acetamide?
2-(2,5-dioxo-4-phenyl-4-propylimidazolidin-1-yl)-N-(4-phenoxyphenyl)acetamide has a molecular weight of 443.50 g/mol, XLogP of 4.66, 8 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-phenyl-4-propylimidazolidin-1-yl)-N-(4-phenoxyphenyl)acetamide is sourced from PubChem (CID 4081516), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).