n-(3-Tert-butyl-1-((tetrahydro-2h-pyran-2-yl)methyl)-1h-pyrazol-5-yl)-2-methoxy-5-(trifluoromethyl)benzamide

HCID 66698366
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Basic information

Standard SMILES
COc1ccc(C(F)(F)F)cc1C(=O)Nc1cc(C(C)(C)C)nn1CC1CCCCO1
InChIKey
SBKFDEYKRPEYHQ-UHFFFAOYSA-N
Molecular formula
C22H28F3N3O3
Average molar mass
439.5 g/mol
Monoisotopic mass
439.20827625

Names & identifiers

Preferred name
n-(3-Tert-butyl-1-((tetrahydro-2h-pyran-2-yl)methyl)-1h-pyrazol-5-yl)-2-methoxy-5-(trifluoromethyl)benzamide
IUPAC
N-[3-tert-butyl-1-(oxan-2-ylmethyl)pyrazol-5-yl]-2-methoxy-5-(trifluoromethyl)benzamide

Names & synonyms

n-(3-tert-butyl-1-((tetrahydro-2h-pyran-2-yl)methyl)-1h-pyrazol-5-yl)-2-methoxy-5-(trifluoromethyl)benzamideSCHEMBL478443

Database identifiers

PubChem CID
66698366

Properties

Computed structural properties

XLogP
4.7
Topological polar surface area
65.4 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
7
Rotatable bonds
6
Heavy atoms
31

Related reactions

2 records
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Compound notes

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