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

C21H23N3O3 — CID 5217376

IUPAC2-[4-methyl-2,5-dioxo-4-(2-phenylethyl)imidazolidin-1-yl]-N-(2-methylphenyl)acetamide
SMILESCc1ccccc1NC(=O)CN1C(=O)NC(C)(CCc2ccccc2)C1=O
InChIInChI=1S/C21H23N3O3/c1-15-8-6-7-11-17(15)22-18(25)14-24-19(26)21(2,23-20(24)27)13-12-16-9-4-3-5-10-16/h3-11H,12-14H2,1-2H3,(H,22,25)(H,23,27)
InChIKeyHZFRBPFKXBGKMZ-UHFFFAOYSA-N
MW365.43 g/mol
LogP2.88
Rot. Bonds6

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

2-[4-methyl-2,5-dioxo-4-(2-phenylethyl)imidazolidin-1-yl]-N-(2-methylphenyl)acetamide (PubChem CID 5217376) has the molecular formula C21H23N3O3 and a molecular weight of 365.43 g/mol. Its IUPAC name is 2-[4-methyl-2,5-dioxo-4-(2-phenylethyl)imidazolidin-1-yl]-N-(2-methylphenyl)acetamide.

Molecular Properties

Compound Name2-[4-methyl-2,5-dioxo-4-(2-phenylethyl)imidazolidin-1-yl]-N-(2-methylphenyl)acetamide
PubChem CID5217376
Molecular FormulaC21H23N3O3
Molecular Weight365.43 g/mol
Exact Mass365.17
IUPAC Name2-[4-methyl-2,5-dioxo-4-(2-phenylethyl)imidazolidin-1-yl]-N-(2-methylphenyl)acetamide
SMILESCc1ccccc1NC(=O)CN1C(=O)NC(C)(CCc2ccccc2)C1=O
InChIInChI=1S/C21H23N3O3/c1-15-8-6-7-11-17(15)22-18(25)14-24-19(26)21(2,23-20(24)27)13-12-16-9-4-3-5-10-16/h3-11H,12-14H2,1-2H3,(H,22,25)(H,23,27)
InChIKeyHZFRBPFKXBGKMZ-UHFFFAOYSA-N
XLogP2.88
TPSA78.51 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms27
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.43
LogP ≤ 52.88
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-[4-methyl-2,5-dioxo-4-(2-phenylethyl)imidazolidin-1-yl]-N-(2-methylphenyl)acetamide?
The IUPAC name of 2-[4-methyl-2,5-dioxo-4-(2-phenylethyl)imidazolidin-1-yl]-N-(2-methylphenyl)acetamide (CID 5217376) is 2-[4-methyl-2,5-dioxo-4-(2-phenylethyl)imidazolidin-1-yl]-N-(2-methylphenyl)acetamide.
What is the SMILES notation for 2-[4-methyl-2,5-dioxo-4-(2-phenylethyl)imidazolidin-1-yl]-N-(2-methylphenyl)acetamide?
The canonical SMILES for 2-[4-methyl-2,5-dioxo-4-(2-phenylethyl)imidazolidin-1-yl]-N-(2-methylphenyl)acetamide is Cc1ccccc1NC(=O)CN1C(=O)NC(C)(CCc2ccccc2)C1=O.
What is the InChIKey of 2-[4-methyl-2,5-dioxo-4-(2-phenylethyl)imidazolidin-1-yl]-N-(2-methylphenyl)acetamide?
The InChIKey is HZFRBPFKXBGKMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H23N3O3/c1-15-8-6-7-11-17(15)22-18(25)14-24-19(26)21(2,23-20(24)27)13-12-16-9-4-3-5-10-16/h3-11H,12-14H2,1-2H3,(H,22,25)(H,23,27).
What are the key properties of 2-[4-methyl-2,5-dioxo-4-(2-phenylethyl)imidazolidin-1-yl]-N-(2-methylphenyl)acetamide?
2-[4-methyl-2,5-dioxo-4-(2-phenylethyl)imidazolidin-1-yl]-N-(2-methylphenyl)acetamide has a molecular weight of 365.43 g/mol, XLogP of 2.88, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-methyl-2,5-dioxo-4-(2-phenylethyl)imidazolidin-1-yl]-N-(2-methylphenyl)acetamide is sourced from PubChem (CID 5217376), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).