N-[6-(3,4-dimethylphenoxy)-3-pyridinyl]-2-(4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl)acetamide

C25H24N4O4 — CID 55750359

IUPACN-[6-(3,4-dimethylphenoxy)-3-pyridinyl]-2-(4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl)acetamide
SMILESCc1ccc(Oc2ccc(NC(=O)CN3C(=O)NC(C)(c4ccccc4)C3=O)cn2)cc1C
InChIInChI=1S/C25H24N4O4/c1-16-9-11-20(13-17(16)2)33-22-12-10-19(14-26-22)27-21(30)15-29-23(31)25(3,28-24(29)32)18-7-5-4-6-8-18/h4-14H,15H2,1-3H3,(H,27,30)(H,28,32)
InChIKeyQQZCZMKPYGSMGI-UHFFFAOYSA-N
MW444.49 g/mol
LogP3.90
Rot. Bonds6

About N-[6-(3,4-dimethylphenoxy)-3-pyridinyl]-2-(4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl)acetamide

N-[6-(3,4-dimethylphenoxy)-3-pyridinyl]-2-(4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl)acetamide (PubChem CID 55750359) has the molecular formula C25H24N4O4 and a molecular weight of 444.49 g/mol. Its IUPAC name is N-[6-(3,4-dimethylphenoxy)-3-pyridinyl]-2-(4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl)acetamide.

Molecular Properties

Compound NameN-[6-(3,4-dimethylphenoxy)-3-pyridinyl]-2-(4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl)acetamide
PubChem CID55750359
Molecular FormulaC25H24N4O4
Molecular Weight444.49 g/mol
Exact Mass444.18
IUPAC NameN-[6-(3,4-dimethylphenoxy)-3-pyridinyl]-2-(4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl)acetamide
SMILESCc1ccc(Oc2ccc(NC(=O)CN3C(=O)NC(C)(c4ccccc4)C3=O)cn2)cc1C
InChIInChI=1S/C25H24N4O4/c1-16-9-11-20(13-17(16)2)33-22-12-10-19(14-26-22)27-21(30)15-29-23(31)25(3,28-24(29)32)18-7-5-4-6-8-18/h4-14H,15H2,1-3H3,(H,27,30)(H,28,32)
InChIKeyQQZCZMKPYGSMGI-UHFFFAOYSA-N
XLogP3.90
TPSA100.63 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500444.49
LogP ≤ 53.90
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

N-(3-chloro-4-methylphenyl)-2-[(4R)-4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl]acetamide
CID 2710976
2-[(4R)-4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl]-N-naphthalen-2-ylacetamide
CID 2580694
2-[4-(4-chlorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-(4-phenoxyphenyl)acetamide
CID 42964194
N-(4-bromophenyl)-2-[(4S)-4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl]acetamide
CID 2580352
2-[(4R)-4-methyl-4-naphthalen-2-yl-2,5-dioxoimidazolidin-1-yl]-N-(4-phenoxyphenyl)acetamide
CID 25436664
N-(3-fluoro-4-methylphenyl)-2-[4-(4-fluorophenyl)-4-methyl-2,5-dioxoimidazolidin-1-yl]acetamide
CID 51250072
2-[4-[4-(difluoromethoxy)phenyl]-4-methyl-2,5-dioxoimidazolidin-1-yl]-N-(4-phenoxyphenyl)acetamide
CID 3965161
N-(3,4-dimethylphenyl)-2-[4-methyl-2,5-dioxo-4-[3-(trifluoromethyl)phenyl]imidazolidin-1-yl]acetamide
CID 46484791
2-(4,4-dimethyl-2,5-dioxoimidazolidin-1-yl)-N-(4-phenoxyphenyl)acetamide
CID 7269459
N-(3,4-dimethylphenyl)-2-[(4S)-4-ethyl-2,5-dioxo-4-phenylimidazolidin-1-yl]acetamide
CID 7179665
N-(4-fluoro-2-methylphenyl)-2-[(4R)-4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl]acetamide
CID 8865010
N-(4-fluoro-2-methylphenyl)-2-[(4S)-4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl]acetamide
CID 8865016

Frequently Asked Questions

What is the IUPAC name of N-[6-(3,4-dimethylphenoxy)-3-pyridinyl]-2-(4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl)acetamide?
The IUPAC name of N-[6-(3,4-dimethylphenoxy)-3-pyridinyl]-2-(4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl)acetamide (CID 55750359) is N-[6-(3,4-dimethylphenoxy)-3-pyridinyl]-2-(4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl)acetamide.
What is the SMILES notation for N-[6-(3,4-dimethylphenoxy)-3-pyridinyl]-2-(4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl)acetamide?
The canonical SMILES for N-[6-(3,4-dimethylphenoxy)-3-pyridinyl]-2-(4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl)acetamide is Cc1ccc(Oc2ccc(NC(=O)CN3C(=O)NC(C)(c4ccccc4)C3=O)cn2)cc1C.
What is the InChIKey of N-[6-(3,4-dimethylphenoxy)-3-pyridinyl]-2-(4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl)acetamide?
The InChIKey is QQZCZMKPYGSMGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H24N4O4/c1-16-9-11-20(13-17(16)2)33-22-12-10-19(14-26-22)27-21(30)15-29-23(31)25(3,28-24(29)32)18-7-5-4-6-8-18/h4-14H,15H2,1-3H3,(H,27,30)(H,28,32).
What are the key properties of N-[6-(3,4-dimethylphenoxy)-3-pyridinyl]-2-(4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl)acetamide?
N-[6-(3,4-dimethylphenoxy)-3-pyridinyl]-2-(4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl)acetamide has a molecular weight of 444.49 g/mol, XLogP of 3.90, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(3,4-dimethylphenoxy)-3-pyridinyl]-2-(4-methyl-2,5-dioxo-4-phenylimidazolidin-1-yl)acetamide is sourced from PubChem (CID 55750359), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).