Basic information
- Standard SMILES
CC(C)(C)NC1CCC(c2ccccc2)(c2ccccc2)C1.CS(=O)(=O)O- InChIKey
NIGPDKTXYPGFJN-UHFFFAOYSA-N- Molecular formula
- C22H31NO3S
- Average molar mass
- 389.6 g/mol
Names & identifiers
- Preferred name
- N-t-butyl-3,3-diphenylcyclopentylamine methanesulfonate
- IUPAC
- N-tert-butyl-3,3-diphenylcyclopentan-1-amine;methanesulfonic acid
Names & synonyms
SCHEMBL9586032NIGPDKTXYPGFJN-UHFFFAOYSA-NN-t-butyl-3,3-diphenylcyclopentylamine methanesulfonate(-)-N-t-butyl-3,3-diphenylcyclopentylamine methanesulfonate
Database identifiers
- PubChem CID
- 19787464
Properties
Computed structural properties
- Topological polar surface area
- 74.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 416
Related reactions
2 records
Compound notes
Loading…