[1-Methyl-2-(3-trifluoromethyl-phenyl)-ethyl]-(3-phenyl-propyl)-amine (HCID 5221975)

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Basic information

Standard SMILES: CC(Cc1cccc(C(F)(F)F)c1)NCCCc1ccccc1
InChIKey: QQJPJXPWFWDIGG-UHFFFAOYSA-N
Molecular formula: C19H22F3N
Average molar mass: 321.4 g/mol

Names & identifiers

Preferred name: [1-Methyl-2-(3-trifluoromethyl-phenyl)-ethyl]-(3-phenyl-propyl)-amine
IUPAC: N-(3-phenylpropyl)-1-[3-(trifluoromethyl)phenyl]propan-2-amine

Names & synonyms

CHEMBL19841[1-Methyl-2-(3-trifluoromethyl-phenyl)-ethyl]-(3-phenyl-propyl)-amineSCHEMBL12648288QQJPJXPWFWDIGG-UHFFFAOYSA-NBDBM50006981NCGC00024693-02PD073864

Database identifiers

PubChem CID: 5221975
ChEMBL: CHEMBL19841
Nikkaji: J412.802H

Properties

Computed structural properties

XLogP: 5.3
Topological polar surface area: 12 Å²
Hydrogen bond donors: 1
Hydrogen bond acceptors: 4
Rotatable bonds: 7
Heavy atoms: 23
Formal charge: 0
Complexity: 323

Related reactions

1 records

New reaction record

HRID 699265As productTraining data from https://doi.org/10.1039/C8SC04228D (3/10)

Compound notes

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