2-(1,3-dioxoisoindol-2-yl)-N-(2-fluorophenyl)acetamide

C16H11FN2O3 — CID 723287

IUPAC2-(1,3-dioxoisoindol-2-yl)-N-(2-fluorophenyl)acetamide
SMILESO=C(CN1C(=O)c2ccccc2C1=O)Nc1ccccc1F
InChIInChI=1S/C16H11FN2O3/c17-12-7-3-4-8-13(12)18-14(20)9-19-15(21)10-5-1-2-6-11(10)16(19)22/h1-8H,9H2,(H,18,20)
InChIKeyLXBMTSUDKRFZND-UHFFFAOYSA-N
MW298.27 g/mol
LogP2.06
Rot. Bonds3

About 2-(1,3-dioxoisoindol-2-yl)-N-(2-fluorophenyl)acetamide

2-(1,3-dioxoisoindol-2-yl)-N-(2-fluorophenyl)acetamide (PubChem CID 723287) has the molecular formula C16H11FN2O3 and a molecular weight of 298.27 g/mol. Its IUPAC name is 2-(1,3-dioxoisoindol-2-yl)-N-(2-fluorophenyl)acetamide.

Molecular Properties

Compound Name2-(1,3-dioxoisoindol-2-yl)-N-(2-fluorophenyl)acetamide
PubChem CID723287
Molecular FormulaC16H11FN2O3
Molecular Weight298.27 g/mol
Exact Mass298.08
IUPAC Name2-(1,3-dioxoisoindol-2-yl)-N-(2-fluorophenyl)acetamide
SMILESO=C(CN1C(=O)c2ccccc2C1=O)Nc1ccccc1F
InChIInChI=1S/C16H11FN2O3/c17-12-7-3-4-8-13(12)18-14(20)9-19-15(21)10-5-1-2-6-11(10)16(19)22/h1-8H,9H2,(H,18,20)
InChIKeyLXBMTSUDKRFZND-UHFFFAOYSA-N
XLogP2.06
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.27
LogP ≤ 52.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

Lenalidomide
CID 216326
N-Phenylphthalimide
CID 68215
ML SA1
CID 2880983
2-(2-Methylphenyl)-1H-isoindole-1,3(2H)-dione
CID 94776
2,3-Dihydro-2-phenyl-1H-isoindol-1-one
CID 97035
Cps 49
CID 9905583
2-(1,3-Dioxo-1,3-dihydro-isoindol-2-YL)-N-P-tolyl-acetamide
CID 344672
3-(1,3-Dioxo-1,3-dihydro-isoindol-2-yl)-N-o-tolyl-propionamide
CID 721309
Cgp53353
CID 6711154
Lenalidomide, (S)-
CID 12044976
SF-51
CID 1219451
2-[4-(dimethylamino)phenyl]-1H-isoindole-1,3(2H)-dione
CID 748674

Frequently Asked Questions

What is the IUPAC name of 2-(1,3-dioxoisoindol-2-yl)-N-(2-fluorophenyl)acetamide?
The IUPAC name of 2-(1,3-dioxoisoindol-2-yl)-N-(2-fluorophenyl)acetamide (CID 723287) is 2-(1,3-dioxoisoindol-2-yl)-N-(2-fluorophenyl)acetamide.
What is the SMILES notation for 2-(1,3-dioxoisoindol-2-yl)-N-(2-fluorophenyl)acetamide?
The canonical SMILES for 2-(1,3-dioxoisoindol-2-yl)-N-(2-fluorophenyl)acetamide is O=C(CN1C(=O)c2ccccc2C1=O)Nc1ccccc1F.
What is the InChIKey of 2-(1,3-dioxoisoindol-2-yl)-N-(2-fluorophenyl)acetamide?
The InChIKey is LXBMTSUDKRFZND-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H11FN2O3/c17-12-7-3-4-8-13(12)18-14(20)9-19-15(21)10-5-1-2-6-11(10)16(19)22/h1-8H,9H2,(H,18,20).
What are the key properties of 2-(1,3-dioxoisoindol-2-yl)-N-(2-fluorophenyl)acetamide?
2-(1,3-dioxoisoindol-2-yl)-N-(2-fluorophenyl)acetamide has a molecular weight of 298.27 g/mol, XLogP of 2.06, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1,3-dioxoisoindol-2-yl)-N-(2-fluorophenyl)acetamide is sourced from PubChem (CID 723287), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).