2-[4-(1,3-dioxoisoindol-2-yl)phenyl]-N-(3-fluorophenyl)acetamide

C22H15FN2O3 — CID 110343512

IUPAC2-[4-(1,3-dioxoisoindol-2-yl)phenyl]-N-(3-fluorophenyl)acetamide
SMILESO=C(Cc1ccc(N2C(=O)c3ccccc3C2=O)cc1)Nc1cccc(F)c1
InChIInChI=1S/C22H15FN2O3/c23-15-4-3-5-16(13-15)24-20(26)12-14-8-10-17(11-9-14)25-21(27)18-6-1-2-7-19(18)22(25)28/h1-11,13H,12H2,(H,24,26)
InChIKeyOMBXSXWVFVOGIO-UHFFFAOYSA-N
MW374.37 g/mol
LogP3.81
Rot. Bonds4

About 2-[4-(1,3-dioxoisoindol-2-yl)phenyl]-N-(3-fluorophenyl)acetamide

2-[4-(1,3-dioxoisoindol-2-yl)phenyl]-N-(3-fluorophenyl)acetamide (PubChem CID 110343512) has the molecular formula C22H15FN2O3 and a molecular weight of 374.37 g/mol. Its IUPAC name is 2-[4-(1,3-dioxoisoindol-2-yl)phenyl]-N-(3-fluorophenyl)acetamide.

Molecular Properties

Compound Name2-[4-(1,3-dioxoisoindol-2-yl)phenyl]-N-(3-fluorophenyl)acetamide
PubChem CID110343512
Molecular FormulaC22H15FN2O3
Molecular Weight374.37 g/mol
Exact Mass374.11
IUPAC Name2-[4-(1,3-dioxoisoindol-2-yl)phenyl]-N-(3-fluorophenyl)acetamide
SMILESO=C(Cc1ccc(N2C(=O)c3ccccc3C2=O)cc1)Nc1cccc(F)c1
InChIInChI=1S/C22H15FN2O3/c23-15-4-3-5-16(13-15)24-20(26)12-14-8-10-17(11-9-14)25-21(27)18-6-1-2-7-19(18)22(25)28/h1-11,13H,12H2,(H,24,26)
InChIKeyOMBXSXWVFVOGIO-UHFFFAOYSA-N
XLogP3.81
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.37
LogP ≤ 53.81
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

N-(2,4-difluorophenyl)-2-[4-(1,3-dioxoisoindol-2-yl)phenyl]acetamide
CID 110343513
2-(4-chlorophenyl)-N-(1,3-dioxo-2-phenylisoindol-5-yl)acetamide
CID 1300069
6-(1,3-dioxoisoindol-2-yl)-N-(3-fluorophenyl)hexanamide
CID 5023404
2-[4-(1,3-dioxoisoindol-2-yl)phenyl]-N-[(2-fluorophenyl)methyl]acetamide
CID 110343482
N-[3-(5,7-dioxopyrrolo[3,4-b]pyridin-6-yl)phenyl]-2-phenylacetamide
CID 113082993
N-(3-fluorophenyl)-2-(4-methylsulfonylphenyl)acetamide
CID 110771361
N-[2-(3-fluoroanilino)-2-oxoethyl]-2-(4-methylphenyl)acetamide
CID 49335487
N-[3-(1,3-dioxoisoindol-2-yl)phenyl]-2-(3,4,5-trimethoxyphenyl)acetamide
CID 56507447
2-(4-ethoxyphenyl)-N-(3-fluorophenyl)acetamide
CID 26579486
2-[4-(1,3-dioxoisoindol-2-yl)phenyl]-N-(1,3-thiazol-2-yl)acetamide
CID 66491223
N-(3-fluorophenyl)-2-(1,1,3-trioxo-1,2-benzothiazol-2-yl)acetamide
CID 892331
2-[2-(1,3-dioxoisoindol-2-yl)ethyl-methylamino]-N-(3-fluorophenyl)acetamide
CID 9250562

Frequently Asked Questions

What is the IUPAC name of 2-[4-(1,3-dioxoisoindol-2-yl)phenyl]-N-(3-fluorophenyl)acetamide?
The IUPAC name of 2-[4-(1,3-dioxoisoindol-2-yl)phenyl]-N-(3-fluorophenyl)acetamide (CID 110343512) is 2-[4-(1,3-dioxoisoindol-2-yl)phenyl]-N-(3-fluorophenyl)acetamide.
What is the SMILES notation for 2-[4-(1,3-dioxoisoindol-2-yl)phenyl]-N-(3-fluorophenyl)acetamide?
The canonical SMILES for 2-[4-(1,3-dioxoisoindol-2-yl)phenyl]-N-(3-fluorophenyl)acetamide is O=C(Cc1ccc(N2C(=O)c3ccccc3C2=O)cc1)Nc1cccc(F)c1.
What is the InChIKey of 2-[4-(1,3-dioxoisoindol-2-yl)phenyl]-N-(3-fluorophenyl)acetamide?
The InChIKey is OMBXSXWVFVOGIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H15FN2O3/c23-15-4-3-5-16(13-15)24-20(26)12-14-8-10-17(11-9-14)25-21(27)18-6-1-2-7-19(18)22(25)28/h1-11,13H,12H2,(H,24,26).
What are the key properties of 2-[4-(1,3-dioxoisoindol-2-yl)phenyl]-N-(3-fluorophenyl)acetamide?
2-[4-(1,3-dioxoisoindol-2-yl)phenyl]-N-(3-fluorophenyl)acetamide has a molecular weight of 374.37 g/mol, XLogP of 3.81, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(1,3-dioxoisoindol-2-yl)phenyl]-N-(3-fluorophenyl)acetamide is sourced from PubChem (CID 110343512), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).