N-(1,3-dioxoisoindol-5-yl)-2-phenoxyacetamide

C16H12N2O4 — CID 881938

IUPACN-(1,3-dioxoisoindol-5-yl)-2-phenoxyacetamide
SMILESO=C(COc1ccccc1)Nc1ccc2c(c1)C(=O)NC2=O
InChIInChI=1S/C16H12N2O4/c19-14(9-22-11-4-2-1-3-5-11)17-10-6-7-12-13(8-10)16(21)18-15(12)20/h1-8H,9H2,(H,17,19)(H,18,20,21)
InChIKeyGJWNHSGIDPIMQK-UHFFFAOYSA-N
MW296.28 g/mol
LogP1.59
Rot. Bonds4

About N-(1,3-dioxoisoindol-5-yl)-2-phenoxyacetamide

N-(1,3-dioxoisoindol-5-yl)-2-phenoxyacetamide (PubChem CID 881938) has the molecular formula C16H12N2O4 and a molecular weight of 296.28 g/mol. Its IUPAC name is N-(1,3-dioxoisoindol-5-yl)-2-phenoxyacetamide.

Molecular Properties

Compound NameN-(1,3-dioxoisoindol-5-yl)-2-phenoxyacetamide
PubChem CID881938
Molecular FormulaC16H12N2O4
Molecular Weight296.28 g/mol
Exact Mass296.08
IUPAC NameN-(1,3-dioxoisoindol-5-yl)-2-phenoxyacetamide
SMILESO=C(COc1ccccc1)Nc1ccc2c(c1)C(=O)NC2=O
InChIInChI=1S/C16H12N2O4/c19-14(9-22-11-4-2-1-3-5-11)17-10-6-7-12-13(8-10)16(21)18-15(12)20/h1-8H,9H2,(H,17,19)(H,18,20,21)
InChIKeyGJWNHSGIDPIMQK-UHFFFAOYSA-N
XLogP1.59
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.28
LogP ≤ 51.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze N-(1,3-dioxoisoindol-5-yl)-2-phenoxyacetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[3-(1,3-dioxoisoindol-5-yl)oxyphenyl]-2-(2-methylphenoxy)acetamide
CID 1319335
N-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)-2-phenoxyacetamide
CID 18571268
N-(4-acetamidophenyl)-2-phenoxyacetamide
CID 675023
N-(3-hydroxy-4-methylphenyl)-2-phenoxyacetamide
CID 837184
N-(3-fluoro-4-hydroxyphenyl)-2-phenoxyacetamide
CID 64780486
N-[3-[(2-bromoacetyl)amino]phenyl]-2-phenoxyacetamide
CID 46736695
2-phenoxy-N-[4-[3-[4-[(2-phenoxyacetyl)amino]phenoxy]phenoxy]phenyl]acetamide
CID 4227761
N-(4-bromo-3-iodophenyl)-2-phenoxyacetamide
CID 114259290
N-(3-chloro-4-fluorophenyl)-2-phenoxyacetamide
CID 924892
N-[3-[[2-(4-methoxyphenoxy)acetyl]amino]phenyl]-2-phenoxyacetamide
CID 17231339
3-[(2-phenoxyacetyl)amino]benzamide
CID 910367
N-(3,4-dichlorophenyl)-2-(4-phenoxyphenoxy)acetamide
CID 2319916

Frequently Asked Questions

What is the IUPAC name of N-(1,3-dioxoisoindol-5-yl)-2-phenoxyacetamide?
The IUPAC name of N-(1,3-dioxoisoindol-5-yl)-2-phenoxyacetamide (CID 881938) is N-(1,3-dioxoisoindol-5-yl)-2-phenoxyacetamide.
What is the SMILES notation for N-(1,3-dioxoisoindol-5-yl)-2-phenoxyacetamide?
The canonical SMILES for N-(1,3-dioxoisoindol-5-yl)-2-phenoxyacetamide is O=C(COc1ccccc1)Nc1ccc2c(c1)C(=O)NC2=O.
What is the InChIKey of N-(1,3-dioxoisoindol-5-yl)-2-phenoxyacetamide?
The InChIKey is GJWNHSGIDPIMQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12N2O4/c19-14(9-22-11-4-2-1-3-5-11)17-10-6-7-12-13(8-10)16(21)18-15(12)20/h1-8H,9H2,(H,17,19)(H,18,20,21).
What are the key properties of N-(1,3-dioxoisoindol-5-yl)-2-phenoxyacetamide?
N-(1,3-dioxoisoindol-5-yl)-2-phenoxyacetamide has a molecular weight of 296.28 g/mol, XLogP of 1.59, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1,3-dioxoisoindol-5-yl)-2-phenoxyacetamide is sourced from PubChem (CID 881938), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).