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

C23H18N2O4 — CID 110352302

IUPACN-[5-(1,3-dioxoisoindol-2-yl)-2-methylphenyl]-2-phenoxyacetamide
SMILESCc1ccc(N2C(=O)c3ccccc3C2=O)cc1NC(=O)COc1ccccc1
InChIInChI=1S/C23H18N2O4/c1-15-11-12-16(25-22(27)18-9-5-6-10-19(18)23(25)28)13-20(15)24-21(26)14-29-17-7-3-2-4-8-17/h2-13H,14H2,1H3,(H,24,26)
InChIKeySYPORARHFUHXFG-UHFFFAOYSA-N
MW386.41 g/mol
LogP3.81
Rot. Bonds5

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

N-[5-(1,3-dioxoisoindol-2-yl)-2-methylphenyl]-2-phenoxyacetamide (PubChem CID 110352302) has the molecular formula C23H18N2O4 and a molecular weight of 386.41 g/mol. Its IUPAC name is N-[5-(1,3-dioxoisoindol-2-yl)-2-methylphenyl]-2-phenoxyacetamide.

Molecular Properties

Compound NameN-[5-(1,3-dioxoisoindol-2-yl)-2-methylphenyl]-2-phenoxyacetamide
PubChem CID110352302
Molecular FormulaC23H18N2O4
Molecular Weight386.41 g/mol
Exact Mass386.13
IUPAC NameN-[5-(1,3-dioxoisoindol-2-yl)-2-methylphenyl]-2-phenoxyacetamide
SMILESCc1ccc(N2C(=O)c3ccccc3C2=O)cc1NC(=O)COc1ccccc1
InChIInChI=1S/C23H18N2O4/c1-15-11-12-16(25-22(27)18-9-5-6-10-19(18)23(25)28)13-20(15)24-21(26)14-29-17-7-3-2-4-8-17/h2-13H,14H2,1H3,(H,24,26)
InChIKeySYPORARHFUHXFG-UHFFFAOYSA-N
XLogP3.81
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500386.41
LogP ≤ 53.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-(5-amino-2-methylphenyl)-2-phenoxyacetamide
CID 16794397
N-(5-bromo-2-methylphenyl)-2-phenoxyacetamide
CID 43806384
4-methyl-3-[(2-phenoxyacetyl)amino]benzoic acid
CID 18070473
2-(4-acetylphenoxy)-N-[3-(1,3-dioxoisoindol-2-yl)phenyl]acetamide
CID 56507840
N-(2,5-dimethylphenyl)-2-[(2-phenoxyacetyl)amino]acetamide
CID 9314105
1-cyclohexyl-3-[5-(1,3-dioxoisoindol-2-yl)-2-methylphenyl]urea
CID 110352303
2-(4-chloro-3,5-dimethylphenoxy)-N-[[2-chloro-4-(1,3-dioxoisoindol-2-yl)phenyl]carbamothioyl]acetamide
CID 4627699
2-(4-methylphenoxy)-N-(2-methylphenyl)acetamide
CID 836156
N-(2,5-dimethylphenyl)-2-[4-[(Z)-[4-oxo-3-(4-phenoxyphenyl)-2-sulfanylidene-1,3-thiazolidin-5-ylidene]methyl]phenoxy]acetamide
CID 126249027
N-[3-(1,3-dioxo-2-phenylisoindol-5-yl)oxyphenyl]-2-phenoxyacetamide
CID 2885505
N-(5-imidazo[1,2-a]pyridin-2-yl-2-methylphenyl)-2-phenoxyacetamide
CID 121055747
N-[4-(5-chloro-1,3-dioxoisoindol-2-yl)-3-methylphenyl]-2-phenoxyacetamide
CID 19169553

Frequently Asked Questions

What is the IUPAC name of N-[5-(1,3-dioxoisoindol-2-yl)-2-methylphenyl]-2-phenoxyacetamide?
The IUPAC name of N-[5-(1,3-dioxoisoindol-2-yl)-2-methylphenyl]-2-phenoxyacetamide (CID 110352302) is N-[5-(1,3-dioxoisoindol-2-yl)-2-methylphenyl]-2-phenoxyacetamide.
What is the SMILES notation for N-[5-(1,3-dioxoisoindol-2-yl)-2-methylphenyl]-2-phenoxyacetamide?
The canonical SMILES for N-[5-(1,3-dioxoisoindol-2-yl)-2-methylphenyl]-2-phenoxyacetamide is Cc1ccc(N2C(=O)c3ccccc3C2=O)cc1NC(=O)COc1ccccc1.
What is the InChIKey of N-[5-(1,3-dioxoisoindol-2-yl)-2-methylphenyl]-2-phenoxyacetamide?
The InChIKey is SYPORARHFUHXFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H18N2O4/c1-15-11-12-16(25-22(27)18-9-5-6-10-19(18)23(25)28)13-20(15)24-21(26)14-29-17-7-3-2-4-8-17/h2-13H,14H2,1H3,(H,24,26).
What are the key properties of N-[5-(1,3-dioxoisoindol-2-yl)-2-methylphenyl]-2-phenoxyacetamide?
N-[5-(1,3-dioxoisoindol-2-yl)-2-methylphenyl]-2-phenoxyacetamide has a molecular weight of 386.41 g/mol, XLogP of 3.81, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(1,3-dioxoisoindol-2-yl)-2-methylphenyl]-2-phenoxyacetamide is sourced from PubChem (CID 110352302), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).