Basic information
- CAS
63980-08-5- Standard SMILES
Cc1ccc(S(=O)(=O)N(C=O)N2CC3CCC2CC3)cc1- InChIKey
QEOXXJRDQNGQLQ-UHFFFAOYSA-N- Molecular formula
- C15H20N2O3S
- Average molar mass
- 308.4 g/mol
- Monoisotopic mass
- 308.11946368
Names & identifiers
- Preferred name
- Formamide, N-2-azabicyclo(2.2.2)oct-2-yl-N-((4-methylphenyl)sulfonyl)-
- IUPAC
- N-(2-azabicyclo[2.2.2]octan-2-yl)-N-(4-methylphenyl)sulfonylformamide
- English name
- N-[2-Azabicyclo[2.2.2]oct-2-yl]-N-[(4-methylphenyl)sulfonyl]formamide
- Molecular formula
- C15H20N2O3S
- Molecular weight
- 308.4
Names & synonyms
N-4-Toluenesulfonyl, isoquinuclidylformamide63980-08-5FORMAMIDE, N-2-AZABICYCLO(2.2.2)OCT-2-YL-N-((4-METHYLPHENYL)SULFONYL)-DTXSID10213846N-2-Azabicyclo(2.2.2)oct-2-yl-N-((4-methylphenyl)sulfonyl)formamideRefChem:345688DTXCID40136337DB-308904N-[2-azabicyclo[2.2.2]oct-2-yl ]-N-[(4-methylphenyl)sulfonyl ]formamideN-(2-Azabicyclo[2.2.2]octan-2-yl)-N-(4-methylbenzene-1-sulfonyl)formamideBenzenesulfonamide, N-2-azabicyclo[2.2.2]oct-2-yl-N-formyl-4-methyl-N-[2-Azabicyclo[2.2.2]oct-2-yl]-N-[(4-methylphenyl)sulfonyl]formamide
Database identifiers
- CAS
63980-08-5- PubChem CID
- 45939
- DTXSID
DTXSID10213846- Nikkaji
- J69.743E
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 66.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 472
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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