methyl 1-[1-[[5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]acetyl]-4-piperidinyl]-1H-pyrazole-3-carboxylate

HCID 67460010
NotesReactions
Substructure searchFind similar structures

Basic information

Standard SMILES
COC(=O)c1ccn(C2CCN(C(=O)Cn3nc(C(F)(F)F)cc3C)CC2)n1
InChIKey
TWDISEQETASQMR-UHFFFAOYSA-N
Molecular formula
C17H20F3N5O3
Average molar mass
399.4 g/mol

Names & identifiers

Preferred name
methyl 1-[1-[[5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]acetyl]-4-piperidinyl]-1H-pyrazole-3-carboxylate
IUPAC
methyl 1-[1-[2-[5-methyl-3-(trifluoromethyl)pyrazol-1-yl]acetyl]piperidin-4-yl]pyrazole-3-carboxylate

Names & synonyms

methyl 1-[1-[[5-methyl-3-(trifluoromethyl)-1H-pyrazol-1-yl]acetyl]-4-piperidinyl]-1H-pyrazole-3-carboxylateSCHEMBL2578127

Database identifiers

PubChem CID
67460010

Properties

Computed structural properties

XLogP
1.8
Topological polar surface area
82.3 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
8
Rotatable bonds
5
Heavy atoms
28

Related reactions

2 records
New reaction record

Compound notes

Loading…