4-[(3-benzyl-2,5-dioxo-4-phenylimidazolidin-1-yl)methyl]-N-phenylbenzamide

C30H25N3O3 — CID 55622382

IUPAC4-[(3-benzyl-2,5-dioxo-4-phenylimidazolidin-1-yl)methyl]-N-phenylbenzamide
SMILESO=C(Nc1ccccc1)c1ccc(CN2C(=O)C(c3ccccc3)N(Cc3ccccc3)C2=O)cc1
InChIInChI=1S/C30H25N3O3/c34-28(31-26-14-8-3-9-15-26)25-18-16-23(17-19-25)21-33-29(35)27(24-12-6-2-7-13-24)32(30(33)36)20-22-10-4-1-5-11-22/h1-19,27H,20-21H2,(H,31,34)
InChIKeyOANMFSCPWUKDCP-UHFFFAOYSA-N
MW475.55 g/mol
LogP5.64
Rot. Bonds7

About 4-[(3-benzyl-2,5-dioxo-4-phenylimidazolidin-1-yl)methyl]-N-phenylbenzamide

4-[(3-benzyl-2,5-dioxo-4-phenylimidazolidin-1-yl)methyl]-N-phenylbenzamide (PubChem CID 55622382) has the molecular formula C30H25N3O3 and a molecular weight of 475.55 g/mol. Its IUPAC name is 4-[(3-benzyl-2,5-dioxo-4-phenylimidazolidin-1-yl)methyl]-N-phenylbenzamide.

Molecular Properties

Compound Name4-[(3-benzyl-2,5-dioxo-4-phenylimidazolidin-1-yl)methyl]-N-phenylbenzamide
PubChem CID55622382
Molecular FormulaC30H25N3O3
Molecular Weight475.55 g/mol
Exact Mass475.19
IUPAC Name4-[(3-benzyl-2,5-dioxo-4-phenylimidazolidin-1-yl)methyl]-N-phenylbenzamide
SMILESO=C(Nc1ccccc1)c1ccc(CN2C(=O)C(c3ccccc3)N(Cc3ccccc3)C2=O)cc1
InChIInChI=1S/C30H25N3O3/c34-28(31-26-14-8-3-9-15-26)25-18-16-23(17-19-25)21-33-29(35)27(24-12-6-2-7-13-24)32(30(33)36)20-22-10-4-1-5-11-22/h1-19,27H,20-21H2,(H,31,34)
InChIKeyOANMFSCPWUKDCP-UHFFFAOYSA-N
XLogP5.64
TPSA69.72 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms36
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500475.55
LogP ≤ 55.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

1-benzyl-5-phenyl-3-[[4-(pyrrolidine-1-carbonyl)phenyl]methyl]imidazolidine-2,4-dione
CID 55733051
4-[(1,3-dioxoisoindol-2-yl)methyl]-N-phenylbenzamide
CID 2995396
4-[[(1-benzyl-4-chloro-2,5-dioxopyrrol-3-yl)amino]methyl]-N-phenylbenzamide
CID 1408099
2-(3-benzyl-2,5-dioxo-4-phenylimidazolidin-1-yl)-N-(3,5-difluorophenyl)acetamide
CID 55733350
2-(3-benzyl-2,5-dioxo-4-phenylimidazolidin-1-yl)-N-(4-pyrrolidin-1-ylphenyl)acetamide
CID 55622157
1-benzyl-3-[[4-(difluoromethylsulfonyl)phenyl]methyl]-5-phenylimidazolidine-2,4-dione
CID 112828513
4-[[(4Z)-4-benzylidene-2,5-dioxoimidazolidin-1-yl]methyl]-N-phenylbenzamide
CID 7897314
N-[4-[(3-benzyl-2,5-dioxo-4-phenylimidazolidin-1-yl)methyl]-1,3-thiazol-2-yl]acetamide
CID 55733110
1-benzyl-3-(2-cyclohexyl-2-oxoethyl)-5-phenylimidazolidine-2,4-dione
CID 55733318
4-[(2R)-3-benzyl-4-oxo-1,3-thiazolidin-2-yl]-N-(4-pyrrolidin-1-ylphenyl)benzamide
CID 100500311
4-[(2S)-3-benzyl-4-oxo-1,3-thiazolidin-2-yl]-N-[3-[(4-tert-butylbenzoyl)amino]phenyl]benzamide
CID 99946733
4-[[4-methyl-4-(4-methylphenyl)-2,5-dioxoimidazolidin-1-yl]methyl]-N-phenylbenzamide
CID 4877614

Frequently Asked Questions

What is the IUPAC name of 4-[(3-benzyl-2,5-dioxo-4-phenylimidazolidin-1-yl)methyl]-N-phenylbenzamide?
The IUPAC name of 4-[(3-benzyl-2,5-dioxo-4-phenylimidazolidin-1-yl)methyl]-N-phenylbenzamide (CID 55622382) is 4-[(3-benzyl-2,5-dioxo-4-phenylimidazolidin-1-yl)methyl]-N-phenylbenzamide.
What is the SMILES notation for 4-[(3-benzyl-2,5-dioxo-4-phenylimidazolidin-1-yl)methyl]-N-phenylbenzamide?
The canonical SMILES for 4-[(3-benzyl-2,5-dioxo-4-phenylimidazolidin-1-yl)methyl]-N-phenylbenzamide is O=C(Nc1ccccc1)c1ccc(CN2C(=O)C(c3ccccc3)N(Cc3ccccc3)C2=O)cc1.
What is the InChIKey of 4-[(3-benzyl-2,5-dioxo-4-phenylimidazolidin-1-yl)methyl]-N-phenylbenzamide?
The InChIKey is OANMFSCPWUKDCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H25N3O3/c34-28(31-26-14-8-3-9-15-26)25-18-16-23(17-19-25)21-33-29(35)27(24-12-6-2-7-13-24)32(30(33)36)20-22-10-4-1-5-11-22/h1-19,27H,20-21H2,(H,31,34).
What are the key properties of 4-[(3-benzyl-2,5-dioxo-4-phenylimidazolidin-1-yl)methyl]-N-phenylbenzamide?
4-[(3-benzyl-2,5-dioxo-4-phenylimidazolidin-1-yl)methyl]-N-phenylbenzamide has a molecular weight of 475.55 g/mol, XLogP of 5.64, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(3-benzyl-2,5-dioxo-4-phenylimidazolidin-1-yl)methyl]-N-phenylbenzamide is sourced from PubChem (CID 55622382), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).