N-[3-(2,5-dioxoimidazolidin-4-yl)phenyl]-2-(3-methylphenoxy)acetamide

C18H17N3O4 — CID 110715491

IUPACN-[3-(2,5-dioxoimidazolidin-4-yl)phenyl]-2-(3-methylphenoxy)acetamide
SMILESCc1cccc(OCC(=O)Nc2cccc(C3NC(=O)NC3=O)c2)c1
InChIInChI=1S/C18H17N3O4/c1-11-4-2-7-14(8-11)25-10-15(22)19-13-6-3-5-12(9-13)16-17(23)21-18(24)20-16/h2-9,16H,10H2,1H3,(H,19,22)(H2,20,21,23,24)
InChIKeyKIUHPUVNDKUAMN-UHFFFAOYSA-N
MW339.35 g/mol
LogP1.89
Rot. Bonds5

About N-[3-(2,5-dioxoimidazolidin-4-yl)phenyl]-2-(3-methylphenoxy)acetamide

N-[3-(2,5-dioxoimidazolidin-4-yl)phenyl]-2-(3-methylphenoxy)acetamide (PubChem CID 110715491) has the molecular formula C18H17N3O4 and a molecular weight of 339.35 g/mol. Its IUPAC name is N-[3-(2,5-dioxoimidazolidin-4-yl)phenyl]-2-(3-methylphenoxy)acetamide.

Molecular Properties

Compound NameN-[3-(2,5-dioxoimidazolidin-4-yl)phenyl]-2-(3-methylphenoxy)acetamide
PubChem CID110715491
Molecular FormulaC18H17N3O4
Molecular Weight339.35 g/mol
Exact Mass339.12
IUPAC NameN-[3-(2,5-dioxoimidazolidin-4-yl)phenyl]-2-(3-methylphenoxy)acetamide
SMILESCc1cccc(OCC(=O)Nc2cccc(C3NC(=O)NC3=O)c2)c1
InChIInChI=1S/C18H17N3O4/c1-11-4-2-7-14(8-11)25-10-15(22)19-13-6-3-5-12(9-13)16-17(23)21-18(24)20-16/h2-9,16H,10H2,1H3,(H,19,22)(H2,20,21,23,24)
InChIKeyKIUHPUVNDKUAMN-UHFFFAOYSA-N
XLogP1.89
TPSA96.53 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.35
LogP ≤ 51.89
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

2-(3-methylphenoxy)-N-(3-methylphenyl)acetamide
CID 2787094
N-(3-aminophenyl)-2-(3-methylphenoxy)acetamide
CID 16789843
N-[3-[[2-(3-methylphenoxy)acetyl]amino]phenyl]propanamide
CID 883065
N-(3-methyl-2-oxo-1,3-dihydroindol-5-yl)-2-(3-methylphenoxy)acetamide
CID 110667031
N-(3-hexoxyphenyl)-2-(3-methylphenoxy)acetamide
CID 17094750
N-[3-(aminomethyl)phenyl]-2-(3-methylphenoxy)acetamide
CID 16783753
2-[3-[(Z)-(2,4-dioxo-1,3-thiazolidin-5-ylidene)methyl]phenoxy]-N-(3-methylphenyl)acetamide
CID 16634167
2-(3-methylphenoxy)-N-(2-oxo-3H-1,3-benzoxazol-6-yl)acetamide
CID 110662124
2-(3-methylphenoxy)-N-(3-oxo-1,2-dihydroisoindol-5-yl)acetamide
CID 86872676
1-benzyl-3-[3-(2,5-dioxoimidazolidin-4-yl)phenyl]urea
CID 110747610
N-[3-(5-oxopyrrolidin-2-yl)phenyl]-2-phenoxyacetamide
CID 167939156
N-(4-bromo-3-methylphenyl)-2-(3-methylphenoxy)acetamide;oxalic acid
CID 171154742

Frequently Asked Questions

What is the IUPAC name of N-[3-(2,5-dioxoimidazolidin-4-yl)phenyl]-2-(3-methylphenoxy)acetamide?
The IUPAC name of N-[3-(2,5-dioxoimidazolidin-4-yl)phenyl]-2-(3-methylphenoxy)acetamide (CID 110715491) is N-[3-(2,5-dioxoimidazolidin-4-yl)phenyl]-2-(3-methylphenoxy)acetamide.
What is the SMILES notation for N-[3-(2,5-dioxoimidazolidin-4-yl)phenyl]-2-(3-methylphenoxy)acetamide?
The canonical SMILES for N-[3-(2,5-dioxoimidazolidin-4-yl)phenyl]-2-(3-methylphenoxy)acetamide is Cc1cccc(OCC(=O)Nc2cccc(C3NC(=O)NC3=O)c2)c1.
What is the InChIKey of N-[3-(2,5-dioxoimidazolidin-4-yl)phenyl]-2-(3-methylphenoxy)acetamide?
The InChIKey is KIUHPUVNDKUAMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17N3O4/c1-11-4-2-7-14(8-11)25-10-15(22)19-13-6-3-5-12(9-13)16-17(23)21-18(24)20-16/h2-9,16H,10H2,1H3,(H,19,22)(H2,20,21,23,24).
What are the key properties of N-[3-(2,5-dioxoimidazolidin-4-yl)phenyl]-2-(3-methylphenoxy)acetamide?
N-[3-(2,5-dioxoimidazolidin-4-yl)phenyl]-2-(3-methylphenoxy)acetamide has a molecular weight of 339.35 g/mol, XLogP of 1.89, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(2,5-dioxoimidazolidin-4-yl)phenyl]-2-(3-methylphenoxy)acetamide is sourced from PubChem (CID 110715491), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).