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2-ethyl-N-(2-pyrrolidin-1-ylcyclohexyl)-4-(trifluoromethyl)benzamide

HCID 66680915
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

Standard SMILES
CCc1cc(C(F)(F)F)ccc1C(=O)NC1CCCCC1N1CCCC1
InChIKey
VDAGRLZAUOLEMS-UHFFFAOYSA-N
Molecular formula
C20H27F3N2O
Average molar mass
368.4 g/mol
Monoisotopic mass
368.20754798

Names & identifiers

Preferred name
2-ethyl-N-(2-pyrrolidin-1-ylcyclohexyl)-4-(trifluoromethyl)benzamide
IUPAC
2-ethyl-N-(2-pyrrolidin-1-ylcyclohexyl)-4-(trifluoromethyl)benzamide

Names & synonyms

SCHEMBL421267

Database identifiers

PubChem CID
66680915

Properties

Computed structural properties

XLogP
4.7
Topological polar surface area
32.3 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
5
Rotatable bonds
4
Heavy atoms
26
Formal charge
0
Complexity
476

Related reactions

1 records
New reaction record
HRID 309053 reaction equation
HRID 309053As productTraining data from https://doi.org/10.1039/C8SC04228D (8/10)

Compound notes

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