Basic information
- Standard SMILES
CC(C)c1cc(CN)cc(NS(C)(=O)=O)c1- InChIKey
MXMXYGBPFDAOOF-UHFFFAOYSA-N- Molecular formula
- C11H18N2O2S
- Average molar mass
- 242.34 g/mol
Names & identifiers
- Preferred name
- N-(3-(aminomethyl)-5-isopropylphenyl)methanesulfonamide
- IUPAC
- N-[3-(aminomethyl)-5-propan-2-ylphenyl]methanesulfonamide
Names & synonyms
N-(3-(aminomethyl)-5-isopropylphenyl)methanesulfonamideN-[3-(aminomethyl)-5-isopropylphenyl]methanesulfonamideSCHEMBL3511044MXMXYGBPFDAOOF-UHFFFAOYSA-NDB-1440401108725-86-5
Database identifiers
- PubChem CID
- 59569737
Properties
Computed structural properties
- XLogP
- 0.9
- Topological polar surface area
- 80.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 308
Related reactions
1 records
Compound notes
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