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

C21H23N3O3 — CID 4017430

IUPAC2-(4-ethyl-2,5-dioxo-4-phenylimidazolidin-1-yl)-N-[(4-methylphenyl)methyl]acetamide
SMILESCCC1(c2ccccc2)NC(=O)N(CC(=O)NCc2ccc(C)cc2)C1=O
InChIInChI=1S/C21H23N3O3/c1-3-21(17-7-5-4-6-8-17)19(26)24(20(27)23-21)14-18(25)22-13-16-11-9-15(2)10-12-16/h4-12H,3,13-14H2,1-2H3,(H,22,25)(H,23,27)
InChIKeyFAFCFDWMWRXWHD-UHFFFAOYSA-N
MW365.43 g/mol
LogP2.47
Rot. Bonds6

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

2-(4-ethyl-2,5-dioxo-4-phenylimidazolidin-1-yl)-N-[(4-methylphenyl)methyl]acetamide (PubChem CID 4017430) has the molecular formula C21H23N3O3 and a molecular weight of 365.43 g/mol. Its IUPAC name is 2-(4-ethyl-2,5-dioxo-4-phenylimidazolidin-1-yl)-N-[(4-methylphenyl)methyl]acetamide.

Molecular Properties

Compound Name2-(4-ethyl-2,5-dioxo-4-phenylimidazolidin-1-yl)-N-[(4-methylphenyl)methyl]acetamide
PubChem CID4017430
Molecular FormulaC21H23N3O3
Molecular Weight365.43 g/mol
Exact Mass365.17
IUPAC Name2-(4-ethyl-2,5-dioxo-4-phenylimidazolidin-1-yl)-N-[(4-methylphenyl)methyl]acetamide
SMILESCCC1(c2ccccc2)NC(=O)N(CC(=O)NCc2ccc(C)cc2)C1=O
InChIInChI=1S/C21H23N3O3/c1-3-21(17-7-5-4-6-8-17)19(26)24(20(27)23-21)14-18(25)22-13-16-11-9-15(2)10-12-16/h4-12H,3,13-14H2,1-2H3,(H,22,25)(H,23,27)
InChIKeyFAFCFDWMWRXWHD-UHFFFAOYSA-N
XLogP2.47
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 ≤ 52.47
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-ethyl-2,5-dioxo-4-phenylimidazolidin-1-yl)-N-[(4-methylphenyl)methyl]acetamide?
The IUPAC name of 2-(4-ethyl-2,5-dioxo-4-phenylimidazolidin-1-yl)-N-[(4-methylphenyl)methyl]acetamide (CID 4017430) is 2-(4-ethyl-2,5-dioxo-4-phenylimidazolidin-1-yl)-N-[(4-methylphenyl)methyl]acetamide.
What is the SMILES notation for 2-(4-ethyl-2,5-dioxo-4-phenylimidazolidin-1-yl)-N-[(4-methylphenyl)methyl]acetamide?
The canonical SMILES for 2-(4-ethyl-2,5-dioxo-4-phenylimidazolidin-1-yl)-N-[(4-methylphenyl)methyl]acetamide is CCC1(c2ccccc2)NC(=O)N(CC(=O)NCc2ccc(C)cc2)C1=O.
What is the InChIKey of 2-(4-ethyl-2,5-dioxo-4-phenylimidazolidin-1-yl)-N-[(4-methylphenyl)methyl]acetamide?
The InChIKey is FAFCFDWMWRXWHD-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H23N3O3/c1-3-21(17-7-5-4-6-8-17)19(26)24(20(27)23-21)14-18(25)22-13-16-11-9-15(2)10-12-16/h4-12H,3,13-14H2,1-2H3,(H,22,25)(H,23,27).
What are the key properties of 2-(4-ethyl-2,5-dioxo-4-phenylimidazolidin-1-yl)-N-[(4-methylphenyl)methyl]acetamide?
2-(4-ethyl-2,5-dioxo-4-phenylimidazolidin-1-yl)-N-[(4-methylphenyl)methyl]acetamide has a molecular weight of 365.43 g/mol, XLogP of 2.47, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-ethyl-2,5-dioxo-4-phenylimidazolidin-1-yl)-N-[(4-methylphenyl)methyl]acetamide is sourced from PubChem (CID 4017430), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).