N-(4-{trans-2-[(2-phenylpiperidin-4-yl)amino]cyclopropyl}phenyl)-3-(trifluoromethyl)benzamide dihydrochloride

HCID 86729902
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Basic information

Standard SMILES
Cl.Cl.O=C(Nc1ccc([C@@H]2C[C@H]2NC2CCNC(c3ccccc3)C2)cc1)c1cccc(C(F)(F)F)c1
InChIKey
WNAPOQVGQPAMMP-SYCBCOQGSA-N
Molecular formula
C28H30Cl2F3N3O
Average molar mass
552.5 g/mol
Monoisotopic mass
551.1718025

Names & identifiers

Preferred name
N-(4-{trans-2-[(2-phenylpiperidin-4-yl)amino]cyclopropyl}phenyl)-3-(trifluoromethyl)benzamide dihydrochloride
IUPAC
N-[4-[(1S,2R)-2-[(2-phenylpiperidin-4-yl)amino]cyclopropyl]phenyl]-3-(trifluoromethyl)benzamide;dihydrochloride

Names & synonyms

N-(4-{trans-2-[(2-phenylpiperidin-4-yl)amino]cyclopropyl}phenyl)-3-(trifluoromethyl)benzamide dihydrochlorideSCHEMBL15789092

Database identifiers

PubChem CID
86729902

Properties

Computed structural properties

Topological polar surface area
53.2 Ų
Hydrogen bond donors
5
Hydrogen bond acceptors
6
Rotatable bonds
6
Heavy atoms
37

Related reactions

1 records
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Compound notes

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