Basic information
- Standard SMILES
CS(=O)(=O)N1CC2(CCNCC2)c2ccccc21- InChIKey
NSECJXCOETXUHS-UHFFFAOYSA-N- Molecular formula
- C13H18N2O2S
- Average molar mass
- 266.36 g/mol
- Monoisotopic mass
- 266.10889899
Names & identifiers
- Preferred name
- 1-(Methylsulfonyl)spiro[indoline-3,4'-piperidine]
- IUPAC
- 1-methylsulfonylspiro[2H-indole-3,4'-piperidine]
Names & synonyms
178261-41-11-(Methylsulfonyl)spiro[indoline-3,4'-piperidine]1-methylsulfonylspiro[2H-indole-3,4'-piperidine]1-methylsulfonyl-spiro[indoline-3,4'-piperidine]1-(methylsulfonyl)spiro[indoline-3,4/'-piperidine]1-methanesulfonyl-1,2-dihydrospiro[indole-3,4'-piperidine]SCHEMBL38332SCHEMBL861460CS-WAA0038CHEMBL5485060SCHEMBL30051797NSECJXCOETXUHS-UHFFFAOYSA-N
Show more names
AKOS005064518DB-065216CS-00353051-methylsulfonylspiro[indoline-3,4'-piperidine]1-(methylsulfonyl)spiro[indoline-3,4'-piperidinel-methylsulfonyl-spiro[indoline-3,4'-piperidine]Spiro[3H-indole-3,4'-piperidine], 1,2-dihydro-1-(methylsulfonyl)-
Database identifiers
- PubChem CID
- 11140073
- ChEMBL
CHEMBL5485060- Nikkaji
- J1.219.955D
Properties
Computed structural properties
- XLogP
- 1
- Topological polar surface area
- 57.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 409
Related reactions
7 records
Compound notes
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