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N-{2,6-Dimethyl-4-[methyl-(4-trifluoromethyl-benzyl)-amino]-phenyl}-acetamide

HCID 11638852
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
CC(=O)Nc1c(C)cc(N(C)Cc2ccc(C(F)(F)F)cc2)cc1C
InChIKey
NPKGBLZCKDGMPK-UHFFFAOYSA-N
Molecular formula
C19H21F3N2O
Average molar mass
350.4 g/mol

Names & identifiers

Preferred name
N-{2,6-Dimethyl-4-[methyl-(4-trifluoromethyl-benzyl)-amino]-phenyl}-acetamide
IUPAC
N-[2,6-dimethyl-4-[methyl-[[4-(trifluoromethyl)phenyl]methyl]amino]phenyl]acetamide

Names & synonyms

N-{2,6-Dimethyl-4-[methyl-(4-trifluoromethyl-benzyl)-amino]-phenyl}-acetamideSCHEMBL3106846

Database identifiers

PubChem CID
11638852

Properties

Computed structural properties

XLogP
4.3
Topological polar surface area
32.3 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
5
Rotatable bonds
4
Heavy atoms
25
Formal charge
0
Complexity
434

Related reactions

3 records
New reaction record
HRID 1559099 reaction equation
HRID 1559099As reactantTraining data from https://doi.org/10.1039/C8SC04228D (1/10)
HRID 1820121 reaction equation
HRID 1820121As reactantuspto-grants-2009_10
HRID 1820148 reaction equation
HRID 1820148As productuspto-grants-2009_10

Compound notes

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