N-(2,3-dimethylphenyl)-2-[[2-[(4S)-4-methyl-4-(4-methylphenyl)-2,5-dioxoimidazolidin-1-yl]acetyl]amino]acetamide

C23H26N4O4 — CID 7242623

IUPACN-(2,3-dimethylphenyl)-2-[[2-[(4S)-4-methyl-4-(4-methylphenyl)-2,5-dioxoimidazolidin-1-yl]acetyl]amino]acetamide
SMILESCc1ccc([C@]2(C)NC(=O)N(CC(=O)NCC(=O)Nc3cccc(C)c3C)C2=O)cc1
InChIInChI=1S/C23H26N4O4/c1-14-8-10-17(11-9-14)23(4)21(30)27(22(31)26-23)13-20(29)24-12-19(28)25-18-7-5-6-15(2)16(18)3/h5-11H,12-13H2,1-4H3,(H,24,29)(H,25,28)(H,26,31)/t23-/m0/s1
InChIKeyAIYZQMGRSNVELW-QHCPKHFHSA-N
MW422.49 g/mol
LogP2.13
Rot. Bonds6

About N-(2,3-dimethylphenyl)-2-[[2-[(4S)-4-methyl-4-(4-methylphenyl)-2,5-dioxoimidazolidin-1-yl]acetyl]amino]acetamide

N-(2,3-dimethylphenyl)-2-[[2-[(4S)-4-methyl-4-(4-methylphenyl)-2,5-dioxoimidazolidin-1-yl]acetyl]amino]acetamide (PubChem CID 7242623) has the molecular formula C23H26N4O4 and a molecular weight of 422.49 g/mol. Its IUPAC name is N-(2,3-dimethylphenyl)-2-[[2-[(4S)-4-methyl-4-(4-methylphenyl)-2,5-dioxoimidazolidin-1-yl]acetyl]amino]acetamide.

Molecular Properties

Compound NameN-(2,3-dimethylphenyl)-2-[[2-[(4S)-4-methyl-4-(4-methylphenyl)-2,5-dioxoimidazolidin-1-yl]acetyl]amino]acetamide
PubChem CID7242623
Molecular FormulaC23H26N4O4
Molecular Weight422.49 g/mol
Exact Mass422.20
IUPAC NameN-(2,3-dimethylphenyl)-2-[[2-[(4S)-4-methyl-4-(4-methylphenyl)-2,5-dioxoimidazolidin-1-yl]acetyl]amino]acetamide
SMILESCc1ccc([C@]2(C)NC(=O)N(CC(=O)NCC(=O)Nc3cccc(C)c3C)C2=O)cc1
InChIInChI=1S/C23H26N4O4/c1-14-8-10-17(11-9-14)23(4)21(30)27(22(31)26-23)13-20(29)24-12-19(28)25-18-7-5-6-15(2)16(18)3/h5-11H,12-13H2,1-4H3,(H,24,29)(H,25,28)(H,26,31)/t23-/m0/s1
InChIKeyAIYZQMGRSNVELW-QHCPKHFHSA-N
XLogP2.13
TPSA107.61 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500422.49
LogP ≤ 52.13
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-(2,3-dimethylphenyl)-2-(4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl)acetamide
CID 17438209
2-[4-(4-cyanophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-(2,3-dimethylphenyl)acetamide
CID 18278725
[2-(2,3-dimethylanilino)-2-oxoethyl] 2-[(4S)-4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl]acetate
CID 7708970
N-(2,3-dimethylphenyl)-2-[(4S)-4-methyl-4-(5-methylfuran-2-yl)-2,5-dioxoimidazolidin-1-yl]acetamide
CID 52510822
N-(2,3-dimethylphenyl)-2-[4-methyl-4-(5-methylfuran-2-yl)-2,5-dioxoimidazolidin-1-yl]acetamide
CID 51132252
N-(2-methoxyphenyl)-2-[(4R)-4-methyl-4-(4-methylphenyl)-2,5-dioxoimidazolidin-1-yl]acetamide
CID 2582081
2-[4-methyl-4-(4-methylphenyl)-2,5-dioxoimidazolidin-1-yl]-N-propylacetamide
CID 42964323
2-[(4R)-4-(4-chlorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-(2-methylphenyl)acetamide
CID 2463493
N-[2-(methylamino)propyl]-2-[4-methyl-4-(4-methylphenyl)-2,5-dioxoimidazolidin-1-yl]acetamide
CID 120831423
2-[4-methyl-4-(4-methylphenyl)-2,5-dioxoimidazolidin-1-yl]-N-(3-methyl-2-pyridinyl)acetamide
CID 43016717
N-(2,3-dimethylphenyl)-2-[(3R)-3-hydroxy-3-(4-methylphenyl)-2-oxoindol-1-yl]acetamide
CID 95095250
N-(2,3-dimethylphenyl)-2-[[2-(6-methyl-2,4-dioxo-1,3-diazaspiro[4.5]decan-3-yl)acetyl]amino]acetamide
CID 24982393

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dimethylphenyl)-2-[[2-[(4S)-4-methyl-4-(4-methylphenyl)-2,5-dioxoimidazolidin-1-yl]acetyl]amino]acetamide?
The IUPAC name of N-(2,3-dimethylphenyl)-2-[[2-[(4S)-4-methyl-4-(4-methylphenyl)-2,5-dioxoimidazolidin-1-yl]acetyl]amino]acetamide (CID 7242623) is N-(2,3-dimethylphenyl)-2-[[2-[(4S)-4-methyl-4-(4-methylphenyl)-2,5-dioxoimidazolidin-1-yl]acetyl]amino]acetamide.
What is the SMILES notation for N-(2,3-dimethylphenyl)-2-[[2-[(4S)-4-methyl-4-(4-methylphenyl)-2,5-dioxoimidazolidin-1-yl]acetyl]amino]acetamide?
The canonical SMILES for N-(2,3-dimethylphenyl)-2-[[2-[(4S)-4-methyl-4-(4-methylphenyl)-2,5-dioxoimidazolidin-1-yl]acetyl]amino]acetamide is Cc1ccc([C@]2(C)NC(=O)N(CC(=O)NCC(=O)Nc3cccc(C)c3C)C2=O)cc1.
What is the InChIKey of N-(2,3-dimethylphenyl)-2-[[2-[(4S)-4-methyl-4-(4-methylphenyl)-2,5-dioxoimidazolidin-1-yl]acetyl]amino]acetamide?
The InChIKey is AIYZQMGRSNVELW-QHCPKHFHSA-N. The full InChI is InChI=1S/C23H26N4O4/c1-14-8-10-17(11-9-14)23(4)21(30)27(22(31)26-23)13-20(29)24-12-19(28)25-18-7-5-6-15(2)16(18)3/h5-11H,12-13H2,1-4H3,(H,24,29)(H,25,28)(H,26,31)/t23-/m0/s1.
What are the key properties of N-(2,3-dimethylphenyl)-2-[[2-[(4S)-4-methyl-4-(4-methylphenyl)-2,5-dioxoimidazolidin-1-yl]acetyl]amino]acetamide?
N-(2,3-dimethylphenyl)-2-[[2-[(4S)-4-methyl-4-(4-methylphenyl)-2,5-dioxoimidazolidin-1-yl]acetyl]amino]acetamide has a molecular weight of 422.49 g/mol, XLogP of 2.13, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dimethylphenyl)-2-[[2-[(4S)-4-methyl-4-(4-methylphenyl)-2,5-dioxoimidazolidin-1-yl]acetyl]amino]acetamide is sourced from PubChem (CID 7242623), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).