Basic information
- Standard SMILES
CC(C)(C)c1cc(CN)c(O)c(S(=O)(=O)N2CCCC2)c1.Cl- InChIKey
AGFRSOZEKZZSLO-UHFFFAOYSA-N- Molecular formula
- C15H25ClN2O3S
- Average molar mass
- 348.9 g/mol
Names & identifiers
- Preferred name
- 2-Aminomethyl-4-(1,1-dimethylethyl)-6-(1-pyrrolidinylsulfonyl)-phenol hydrochloride
- IUPAC
- 2-(aminomethyl)-4-tert-butyl-6-pyrrolidin-1-ylsulfonylphenol;hydrochloride
Names & synonyms
SCHEMBL10640173AGFRSOZEKZZSLO-UHFFFAOYSA-N2-Aminomethyl-4-(1,1-dimethylethyl)-6-(1-pyrrolidinylsulfonyl)-phenol hydrochloride
Database identifiers
- PubChem CID
- 21296907
Properties
Computed structural properties
- Topological polar surface area
- 92 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 447
Related reactions
2 records
Compound notes
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