3-[[2-(4-ethyl-2,5-dioxo-4-phenylimidazolidin-1-yl)acetyl]amino]-4-methoxy-N,N-dimethylbenzamide

C23H26N4O5 — CID 55893836

IUPAC3-[[2-(4-ethyl-2,5-dioxo-4-phenylimidazolidin-1-yl)acetyl]amino]-4-methoxy-N,N-dimethylbenzamide
SMILESCCC1(c2ccccc2)NC(=O)N(CC(=O)Nc2cc(C(=O)N(C)C)ccc2OC)C1=O
InChIInChI=1S/C23H26N4O5/c1-5-23(16-9-7-6-8-10-16)21(30)27(22(31)25-23)14-19(28)24-17-13-15(20(29)26(2)3)11-12-18(17)32-4/h6-13H,5,14H2,1-4H3,(H,24,28)(H,25,31)
InChIKeyYCUJQVRGANITPF-UHFFFAOYSA-N
MW438.48 g/mol
LogP2.19
Rot. Bonds7

About 3-[[2-(4-ethyl-2,5-dioxo-4-phenylimidazolidin-1-yl)acetyl]amino]-4-methoxy-N,N-dimethylbenzamide

3-[[2-(4-ethyl-2,5-dioxo-4-phenylimidazolidin-1-yl)acetyl]amino]-4-methoxy-N,N-dimethylbenzamide (PubChem CID 55893836) has the molecular formula C23H26N4O5 and a molecular weight of 438.48 g/mol. Its IUPAC name is 3-[[2-(4-ethyl-2,5-dioxo-4-phenylimidazolidin-1-yl)acetyl]amino]-4-methoxy-N,N-dimethylbenzamide.

Molecular Properties

Compound Name3-[[2-(4-ethyl-2,5-dioxo-4-phenylimidazolidin-1-yl)acetyl]amino]-4-methoxy-N,N-dimethylbenzamide
PubChem CID55893836
Molecular FormulaC23H26N4O5
Molecular Weight438.48 g/mol
Exact Mass438.19
IUPAC Name3-[[2-(4-ethyl-2,5-dioxo-4-phenylimidazolidin-1-yl)acetyl]amino]-4-methoxy-N,N-dimethylbenzamide
SMILESCCC1(c2ccccc2)NC(=O)N(CC(=O)Nc2cc(C(=O)N(C)C)ccc2OC)C1=O
InChIInChI=1S/C23H26N4O5/c1-5-23(16-9-7-6-8-10-16)21(30)27(22(31)25-23)14-19(28)24-17-13-15(20(29)26(2)3)11-12-18(17)32-4/h6-13H,5,14H2,1-4H3,(H,24,28)(H,25,31)
InChIKeyYCUJQVRGANITPF-UHFFFAOYSA-N
XLogP2.19
TPSA108.05 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500438.48
LogP ≤ 52.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

2-[(4S)-4-ethyl-2,5-dioxo-4-phenylimidazolidin-1-yl]-N-(2-methoxy-5-methylphenyl)acetamide
CID 2582592
4-[[2-[(4R)-4-ethyl-2,5-dioxo-4-phenylimidazolidin-1-yl]acetyl]amino]-N,N-dimethylbenzamide
CID 2582874
methyl 2-[[2-(4-ethyl-2,5-dioxo-4-phenylimidazolidin-1-yl)acetyl]amino]-4,5-dimethoxybenzoate
CID 16549652
methyl 3-[[2-(4-ethyl-2,5-dioxo-4-phenylimidazolidin-1-yl)acetyl]amino]-4-methylbenzoate
CID 16550511
2-[(4R)-4-(3-chlorophenyl)-4-ethyl-2,5-dioxoimidazolidin-1-yl]-N-(2,5-dimethoxyphenyl)acetamide
CID 41208228
2-[(4S)-4-ethyl-2,5-dioxo-4-phenylimidazolidin-1-yl]-N-(2-methoxydibenzofuran-3-yl)acetamide
CID 40940422
2-(4-benzyl-2,5-dioxo-4-phenylimidazolidin-1-yl)-N-(2-methoxy-5-methylphenyl)acetamide
CID 42986255
2-[(4R)-4-ethyl-2,5-dioxo-4-phenylimidazolidin-1-yl]-N-(2-fluorophenyl)acetamide
CID 2582848
N-(3,4-dimethylphenyl)-2-[(4S)-4-ethyl-2,5-dioxo-4-phenylimidazolidin-1-yl]acetamide
CID 7179665
2-(4-ethyl-2,5-dioxo-4-phenylimidazolidin-1-yl)-N-[1-(2-methoxyphenyl)ethyl]acetamide
CID 24544890
2-[(4S)-4-ethyl-4-(4-methoxyphenyl)-2,5-dioxoimidazolidin-1-yl]-N-(2-methylphenyl)acetamide
CID 7595447
2-(4-ethyl-2,5-dioxo-4-phenylimidazolidin-1-yl)-N-(2-fluoro-4-methylphenyl)acetamide
CID 16545970

Frequently Asked Questions

What is the IUPAC name of 3-[[2-(4-ethyl-2,5-dioxo-4-phenylimidazolidin-1-yl)acetyl]amino]-4-methoxy-N,N-dimethylbenzamide?
The IUPAC name of 3-[[2-(4-ethyl-2,5-dioxo-4-phenylimidazolidin-1-yl)acetyl]amino]-4-methoxy-N,N-dimethylbenzamide (CID 55893836) is 3-[[2-(4-ethyl-2,5-dioxo-4-phenylimidazolidin-1-yl)acetyl]amino]-4-methoxy-N,N-dimethylbenzamide.
What is the SMILES notation for 3-[[2-(4-ethyl-2,5-dioxo-4-phenylimidazolidin-1-yl)acetyl]amino]-4-methoxy-N,N-dimethylbenzamide?
The canonical SMILES for 3-[[2-(4-ethyl-2,5-dioxo-4-phenylimidazolidin-1-yl)acetyl]amino]-4-methoxy-N,N-dimethylbenzamide is CCC1(c2ccccc2)NC(=O)N(CC(=O)Nc2cc(C(=O)N(C)C)ccc2OC)C1=O.
What is the InChIKey of 3-[[2-(4-ethyl-2,5-dioxo-4-phenylimidazolidin-1-yl)acetyl]amino]-4-methoxy-N,N-dimethylbenzamide?
The InChIKey is YCUJQVRGANITPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H26N4O5/c1-5-23(16-9-7-6-8-10-16)21(30)27(22(31)25-23)14-19(28)24-17-13-15(20(29)26(2)3)11-12-18(17)32-4/h6-13H,5,14H2,1-4H3,(H,24,28)(H,25,31).
What are the key properties of 3-[[2-(4-ethyl-2,5-dioxo-4-phenylimidazolidin-1-yl)acetyl]amino]-4-methoxy-N,N-dimethylbenzamide?
3-[[2-(4-ethyl-2,5-dioxo-4-phenylimidazolidin-1-yl)acetyl]amino]-4-methoxy-N,N-dimethylbenzamide has a molecular weight of 438.48 g/mol, XLogP of 2.19, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[[2-(4-ethyl-2,5-dioxo-4-phenylimidazolidin-1-yl)acetyl]amino]-4-methoxy-N,N-dimethylbenzamide is sourced from PubChem (CID 55893836), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).