Basic information
- Standard SMILES
Cc1ccc(CC(C)(C)NCC(O)c2cccc(Cl)c2)cc1- InChIKey
HGIKNICSSRXDBB-UHFFFAOYSA-N- Molecular formula
- C19H24ClNO
- Average molar mass
- 317.9 g/mol
- Monoisotopic mass
- 317.1546421
Names & identifiers
- Preferred name
- N-(2-(4-Methylphenyl)-1,1-dimethylethyl)-2-hydroxy-2-(3-chlorophenyl)ethanamine
- IUPAC
- 1-(3-chlorophenyl)-2-[[2-methyl-1-(4-methylphenyl)propan-2-yl]amino]ethanol
Names & synonyms
SCHEMBL10893060HGIKNICSSRXDBB-UHFFFAOYSA-NN-(2-(4-Methylphenyl)-1,1-dimethylethyl)-2-hydroxy-2-(3-chlorophenyl)ethanamine
Database identifiers
- PubChem CID
- 23322165
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 32.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 6
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 325
Related reactions
1 records
Compound notes
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