(3R)-3-[2-(3-fluoro-2-pyridinyl)phenyl]-1-phenylpyrrolidine-2,5-dione

C21H15FN2O2 — CID 166445454

IUPAC(3R)-3-[2-(3-fluoro-2-pyridinyl)phenyl]-1-phenylpyrrolidine-2,5-dione
SMILESO=C1C[C@H](c2ccccc2-c2ncccc2F)C(=O)N1c1ccccc1
InChIInChI=1S/C21H15FN2O2/c22-18-11-6-12-23-20(18)16-10-5-4-9-15(16)17-13-19(25)24(21(17)26)14-7-2-1-3-8-14/h1-12,17H,13H2/t17-/m1/s1
InChIKeySNXAYKAITMRAKV-QGZVFWFLSA-N
MW346.36 g/mol
LogP3.93
Rot. Bonds3

About (3R)-3-[2-(3-fluoro-2-pyridinyl)phenyl]-1-phenylpyrrolidine-2,5-dione

(3R)-3-[2-(3-fluoro-2-pyridinyl)phenyl]-1-phenylpyrrolidine-2,5-dione (PubChem CID 166445454) has the molecular formula C21H15FN2O2 and a molecular weight of 346.36 g/mol. Its IUPAC name is (3R)-3-[2-(3-fluoro-2-pyridinyl)phenyl]-1-phenylpyrrolidine-2,5-dione.

Molecular Properties

Compound Name(3R)-3-[2-(3-fluoro-2-pyridinyl)phenyl]-1-phenylpyrrolidine-2,5-dione
PubChem CID166445454
Molecular FormulaC21H15FN2O2
Molecular Weight346.36 g/mol
Exact Mass346.11
IUPAC Name(3R)-3-[2-(3-fluoro-2-pyridinyl)phenyl]-1-phenylpyrrolidine-2,5-dione
SMILESO=C1C[C@H](c2ccccc2-c2ncccc2F)C(=O)N1c1ccccc1
InChIInChI=1S/C21H15FN2O2/c22-18-11-6-12-23-20(18)16-10-5-4-9-15(16)17-13-19(25)24(21(17)26)14-7-2-1-3-8-14/h1-12,17H,13H2/t17-/m1/s1
InChIKeySNXAYKAITMRAKV-QGZVFWFLSA-N
XLogP3.93
TPSA50.27 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.36
LogP ≤ 53.93
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

5-(2,5-dioxo-1-phenylpyrrolidin-3-yl)-2-phenyl-3a,4,5,9b-tetrahydropyrrolo[3,4-f]quinoline-1,3-dione
CID 12579892
(3R)-3-(1H-indol-3-yl)-1-phenylpyrrolidine-2,5-dione
CID 919331
1-(4-bromo-3-fluorophenyl)-3-phenylpyrrolidine-2,5-dione
CID 65430330
(3R)-1-phenyl-3-(trifluoromethyl)pyrrolidine-2,5-dione
CID 138974226
3-(2-fluorophenyl)-1-[(4-pyrimidin-2-ylpiperazin-1-yl)methyl]pyrrolidine-2,5-dione
CID 70697297
(3S)-3-(5-amino-1,3-dimethylpyrazol-4-yl)-1-phenylpyrrolidine-2,5-dione
CID 95391546
16-phenyl-16-azatetracyclo[6.6.3.02,7.09,14]heptadeca-2,4,6,9,11,13-hexaene-15,17-dione
CID 102335192
1-phenyl-3-(1-propylindol-3-yl)pyrrolidine-2,5-dione
CID 23605678
(3S)-3-[(2-fluorophenyl)methylamino]-1-phenylpyrrolidine-2,5-dione
CID 820411
(3R)-3-[(2-fluorophenyl)methylamino]-1-phenylpyrrolidine-2,5-dione
CID 820410
2-(2,3-dichlorophenyl)-3-fluoropyridine
CID 118819260
3-(2-aminoethylamino)-1-phenylpyrrolidine-2,5-dione
CID 43637577

Frequently Asked Questions

What is the IUPAC name of (3R)-3-[2-(3-fluoro-2-pyridinyl)phenyl]-1-phenylpyrrolidine-2,5-dione?
The IUPAC name of (3R)-3-[2-(3-fluoro-2-pyridinyl)phenyl]-1-phenylpyrrolidine-2,5-dione (CID 166445454) is (3R)-3-[2-(3-fluoro-2-pyridinyl)phenyl]-1-phenylpyrrolidine-2,5-dione.
What is the SMILES notation for (3R)-3-[2-(3-fluoro-2-pyridinyl)phenyl]-1-phenylpyrrolidine-2,5-dione?
The canonical SMILES for (3R)-3-[2-(3-fluoro-2-pyridinyl)phenyl]-1-phenylpyrrolidine-2,5-dione is O=C1C[C@H](c2ccccc2-c2ncccc2F)C(=O)N1c1ccccc1.
What is the InChIKey of (3R)-3-[2-(3-fluoro-2-pyridinyl)phenyl]-1-phenylpyrrolidine-2,5-dione?
The InChIKey is SNXAYKAITMRAKV-QGZVFWFLSA-N. The full InChI is InChI=1S/C21H15FN2O2/c22-18-11-6-12-23-20(18)16-10-5-4-9-15(16)17-13-19(25)24(21(17)26)14-7-2-1-3-8-14/h1-12,17H,13H2/t17-/m1/s1.
What are the key properties of (3R)-3-[2-(3-fluoro-2-pyridinyl)phenyl]-1-phenylpyrrolidine-2,5-dione?
(3R)-3-[2-(3-fluoro-2-pyridinyl)phenyl]-1-phenylpyrrolidine-2,5-dione has a molecular weight of 346.36 g/mol, XLogP of 3.93, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-3-[2-(3-fluoro-2-pyridinyl)phenyl]-1-phenylpyrrolidine-2,5-dione is sourced from PubChem (CID 166445454), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).