2-(2,5-dioxo-4-phenyl-4-propylimidazolidin-1-yl)-N-[(4-methylphenyl)methyl]acetamide

C22H25N3O3 — CID 5145663

IUPAC2-(2,5-dioxo-4-phenyl-4-propylimidazolidin-1-yl)-N-[(4-methylphenyl)methyl]acetamide
SMILESCCCC1(c2ccccc2)NC(=O)N(CC(=O)NCc2ccc(C)cc2)C1=O
InChIInChI=1S/C22H25N3O3/c1-3-13-22(18-7-5-4-6-8-18)20(27)25(21(28)24-22)15-19(26)23-14-17-11-9-16(2)10-12-17/h4-12H,3,13-15H2,1-2H3,(H,23,26)(H,24,28)
InChIKeyMYSNECXVQLAGMN-UHFFFAOYSA-N
MW379.46 g/mol
LogP2.86
Rot. Bonds7

About 2-(2,5-dioxo-4-phenyl-4-propylimidazolidin-1-yl)-N-[(4-methylphenyl)methyl]acetamide

2-(2,5-dioxo-4-phenyl-4-propylimidazolidin-1-yl)-N-[(4-methylphenyl)methyl]acetamide (PubChem CID 5145663) has the molecular formula C22H25N3O3 and a molecular weight of 379.46 g/mol. Its IUPAC name is 2-(2,5-dioxo-4-phenyl-4-propylimidazolidin-1-yl)-N-[(4-methylphenyl)methyl]acetamide.

Molecular Properties

Compound Name2-(2,5-dioxo-4-phenyl-4-propylimidazolidin-1-yl)-N-[(4-methylphenyl)methyl]acetamide
PubChem CID5145663
Molecular FormulaC22H25N3O3
Molecular Weight379.46 g/mol
Exact Mass379.19
IUPAC Name2-(2,5-dioxo-4-phenyl-4-propylimidazolidin-1-yl)-N-[(4-methylphenyl)methyl]acetamide
SMILESCCCC1(c2ccccc2)NC(=O)N(CC(=O)NCc2ccc(C)cc2)C1=O
InChIInChI=1S/C22H25N3O3/c1-3-13-22(18-7-5-4-6-8-18)20(27)25(21(28)24-22)15-19(26)23-14-17-11-9-16(2)10-12-17/h4-12H,3,13-15H2,1-2H3,(H,23,26)(H,24,28)
InChIKeyMYSNECXVQLAGMN-UHFFFAOYSA-N
XLogP2.86
TPSA78.51 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500379.46
LogP ≤ 52.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-(2,5-dioxo-4-phenyl-4-propylimidazolidin-1-yl)-N-[(4-methylphenyl)methyl]acetamide?
The IUPAC name of 2-(2,5-dioxo-4-phenyl-4-propylimidazolidin-1-yl)-N-[(4-methylphenyl)methyl]acetamide (CID 5145663) is 2-(2,5-dioxo-4-phenyl-4-propylimidazolidin-1-yl)-N-[(4-methylphenyl)methyl]acetamide.
What is the SMILES notation for 2-(2,5-dioxo-4-phenyl-4-propylimidazolidin-1-yl)-N-[(4-methylphenyl)methyl]acetamide?
The canonical SMILES for 2-(2,5-dioxo-4-phenyl-4-propylimidazolidin-1-yl)-N-[(4-methylphenyl)methyl]acetamide is CCCC1(c2ccccc2)NC(=O)N(CC(=O)NCc2ccc(C)cc2)C1=O.
What is the InChIKey of 2-(2,5-dioxo-4-phenyl-4-propylimidazolidin-1-yl)-N-[(4-methylphenyl)methyl]acetamide?
The InChIKey is MYSNECXVQLAGMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H25N3O3/c1-3-13-22(18-7-5-4-6-8-18)20(27)25(21(28)24-22)15-19(26)23-14-17-11-9-16(2)10-12-17/h4-12H,3,13-15H2,1-2H3,(H,23,26)(H,24,28).
What are the key properties of 2-(2,5-dioxo-4-phenyl-4-propylimidazolidin-1-yl)-N-[(4-methylphenyl)methyl]acetamide?
2-(2,5-dioxo-4-phenyl-4-propylimidazolidin-1-yl)-N-[(4-methylphenyl)methyl]acetamide has a molecular weight of 379.46 g/mol, XLogP of 2.86, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,5-dioxo-4-phenyl-4-propylimidazolidin-1-yl)-N-[(4-methylphenyl)methyl]acetamide is sourced from PubChem (CID 5145663), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).