2-(1,3-dioxoisoindol-2-yl)-N-ethyl-N-phenylacetamide

C18H16N2O3 — CID 884073

IUPAC2-(1,3-dioxoisoindol-2-yl)-N-ethyl-N-phenylacetamide
SMILESCCN(C(=O)CN1C(=O)c2ccccc2C1=O)c1ccccc1
InChIInChI=1S/C18H16N2O3/c1-2-19(13-8-4-3-5-9-13)16(21)12-20-17(22)14-10-6-7-11-15(14)18(20)23/h3-11H,2,12H2,1H3
InChIKeyGFNPTHMHJCSMEG-UHFFFAOYSA-N
MW308.34 g/mol
LogP2.34
Rot. Bonds4

About 2-(1,3-dioxoisoindol-2-yl)-N-ethyl-N-phenylacetamide

2-(1,3-dioxoisoindol-2-yl)-N-ethyl-N-phenylacetamide (PubChem CID 884073) has the molecular formula C18H16N2O3 and a molecular weight of 308.34 g/mol. Its IUPAC name is 2-(1,3-dioxoisoindol-2-yl)-N-ethyl-N-phenylacetamide.

Molecular Properties

Compound Name2-(1,3-dioxoisoindol-2-yl)-N-ethyl-N-phenylacetamide
PubChem CID884073
Molecular FormulaC18H16N2O3
Molecular Weight308.34 g/mol
Exact Mass308.12
IUPAC Name2-(1,3-dioxoisoindol-2-yl)-N-ethyl-N-phenylacetamide
SMILESCCN(C(=O)CN1C(=O)c2ccccc2C1=O)c1ccccc1
InChIInChI=1S/C18H16N2O3/c1-2-19(13-8-4-3-5-9-13)16(21)12-20-17(22)14-10-6-7-11-15(14)18(20)23/h3-11H,2,12H2,1H3
InChIKeyGFNPTHMHJCSMEG-UHFFFAOYSA-N
XLogP2.34
TPSA57.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.34
LogP ≤ 52.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-[2-(4-chloro-N-methylanilino)-2-oxoethyl]-2-(1,3-dioxoisoindol-2-yl)-N-phenylacetamide
CID 14996846
N,N'-diethyl-N,N'-diphenylpropanediamide
CID 14847934
2-(5,6-dichloro-1,3-dioxoisoindol-2-yl)-N-ethyl-N-(4-fluorophenyl)acetamide
CID 7488869
2-(N-[2-(1,3-dioxoisoindol-2-yl)acetyl]-2-methylanilino)acetic acid
CID 67782299
2-(1,3-dioxoisoindol-2-yl)-N-ethyl-N-prop-2-enylacetamide
CID 84558909
N-benzhydryl-2-(1,3-dioxoisoindol-2-yl)-N-methylacetamide
CID 8918958
N-(2-cyanoethyl)-2-(1,3-dioxoisoindol-2-yl)-N-ethylacetamide
CID 87018280
N-benzyl-N-butan-2-yl-2-(1,3-dioxoisoindol-2-yl)acetamide
CID 43025130
N-ethyl-2-[2-(N-ethylanilino)-2-oxoethoxy]-N-phenylacetamide
CID 52563694
N-[2-(3,4-dihydro-2H-1,2-benzothiazin-4-yl)-2-oxoethyl]-2-(1,3-dioxoisoindol-2-yl)-N-phenylacetamide
CID 67785698
N-ethyl-2-[5-(2-methylphenyl)tetrazol-2-yl]-N-phenylacetamide
CID 7634888
[2-(N-benzylanilino)-2-oxoethyl] 2-(1,3-dioxoisoindol-2-yl)acetate
CID 55467802

Frequently Asked Questions

What is the IUPAC name of 2-(1,3-dioxoisoindol-2-yl)-N-ethyl-N-phenylacetamide?
The IUPAC name of 2-(1,3-dioxoisoindol-2-yl)-N-ethyl-N-phenylacetamide (CID 884073) is 2-(1,3-dioxoisoindol-2-yl)-N-ethyl-N-phenylacetamide.
What is the SMILES notation for 2-(1,3-dioxoisoindol-2-yl)-N-ethyl-N-phenylacetamide?
The canonical SMILES for 2-(1,3-dioxoisoindol-2-yl)-N-ethyl-N-phenylacetamide is CCN(C(=O)CN1C(=O)c2ccccc2C1=O)c1ccccc1.
What is the InChIKey of 2-(1,3-dioxoisoindol-2-yl)-N-ethyl-N-phenylacetamide?
The InChIKey is GFNPTHMHJCSMEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16N2O3/c1-2-19(13-8-4-3-5-9-13)16(21)12-20-17(22)14-10-6-7-11-15(14)18(20)23/h3-11H,2,12H2,1H3.
What are the key properties of 2-(1,3-dioxoisoindol-2-yl)-N-ethyl-N-phenylacetamide?
2-(1,3-dioxoisoindol-2-yl)-N-ethyl-N-phenylacetamide has a molecular weight of 308.34 g/mol, XLogP of 2.34, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1,3-dioxoisoindol-2-yl)-N-ethyl-N-phenylacetamide is sourced from PubChem (CID 884073), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).