(2'S,3S)-2'-(3-fluorophenyl)spiro[1H-indole-3,3'-pyrrolidine]-2-one

C17H15FN2O — CID 51971151

IUPAC(2'S,3S)-2'-(3-fluorophenyl)spiro[1H-indole-3,3'-pyrrolidine]-2-one
SMILESO=C1Nc2ccccc2[C@]12CCN[C@H]2c1cccc(F)c1
InChIInChI=1S/C17H15FN2O/c18-12-5-3-4-11(10-12)15-17(8-9-19-15)13-6-1-2-7-14(13)20-16(17)21/h1-7,10,15,19H,8-9H2,(H,20,21)/t15-,17-/m0/s1
InChIKeyNBKCFZMTICAELA-RDJZCZTQSA-N
MW282.32 g/mol
LogP2.75
Rot. Bonds1

About (2'S,3S)-2'-(3-fluorophenyl)spiro[1H-indole-3,3'-pyrrolidine]-2-one

(2'S,3S)-2'-(3-fluorophenyl)spiro[1H-indole-3,3'-pyrrolidine]-2-one (PubChem CID 51971151) has the molecular formula C17H15FN2O and a molecular weight of 282.32 g/mol. Its IUPAC name is (2'S,3S)-2'-(3-fluorophenyl)spiro[1H-indole-3,3'-pyrrolidine]-2-one.

Molecular Properties

Compound Name(2'S,3S)-2'-(3-fluorophenyl)spiro[1H-indole-3,3'-pyrrolidine]-2-one
PubChem CID51971151
Molecular FormulaC17H15FN2O
Molecular Weight282.32 g/mol
Exact Mass282.12
IUPAC Name(2'S,3S)-2'-(3-fluorophenyl)spiro[1H-indole-3,3'-pyrrolidine]-2-one
SMILESO=C1Nc2ccccc2[C@]12CCN[C@H]2c1cccc(F)c1
InChIInChI=1S/C17H15FN2O/c18-12-5-3-4-11(10-12)15-17(8-9-19-15)13-6-1-2-7-14(13)20-16(17)21/h1-7,10,15,19H,8-9H2,(H,20,21)/t15-,17-/m0/s1
InChIKeyNBKCFZMTICAELA-RDJZCZTQSA-N
XLogP2.75
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.32
LogP ≤ 52.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze (2'S,3S)-2'-(3-fluorophenyl)spiro[1H-indole-3,3'-pyrrolidine]-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (2'S,3S)-2'-(3-fluorophenyl)spiro[1H-indole-3,3'-pyrrolidine]-2-one?
The IUPAC name of (2'S,3S)-2'-(3-fluorophenyl)spiro[1H-indole-3,3'-pyrrolidine]-2-one (CID 51971151) is (2'S,3S)-2'-(3-fluorophenyl)spiro[1H-indole-3,3'-pyrrolidine]-2-one.
What is the SMILES notation for (2'S,3S)-2'-(3-fluorophenyl)spiro[1H-indole-3,3'-pyrrolidine]-2-one?
The canonical SMILES for (2'S,3S)-2'-(3-fluorophenyl)spiro[1H-indole-3,3'-pyrrolidine]-2-one is O=C1Nc2ccccc2[C@]12CCN[C@H]2c1cccc(F)c1.
What is the InChIKey of (2'S,3S)-2'-(3-fluorophenyl)spiro[1H-indole-3,3'-pyrrolidine]-2-one?
The InChIKey is NBKCFZMTICAELA-RDJZCZTQSA-N. The full InChI is InChI=1S/C17H15FN2O/c18-12-5-3-4-11(10-12)15-17(8-9-19-15)13-6-1-2-7-14(13)20-16(17)21/h1-7,10,15,19H,8-9H2,(H,20,21)/t15-,17-/m0/s1.
What are the key properties of (2'S,3S)-2'-(3-fluorophenyl)spiro[1H-indole-3,3'-pyrrolidine]-2-one?
(2'S,3S)-2'-(3-fluorophenyl)spiro[1H-indole-3,3'-pyrrolidine]-2-one has a molecular weight of 282.32 g/mol, XLogP of 2.75, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2'S,3S)-2'-(3-fluorophenyl)spiro[1H-indole-3,3'-pyrrolidine]-2-one is sourced from PubChem (CID 51971151), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).