HomeMCPWorkbenchSkills
HomeWorkbenchNotificationsMe
llms.txt · MCP GuidePrivacy Policy · Terms of Service · Supportv1.8.0
  1. Home
  2. /Compound

N-[4-(5-trifluoromethylbenzoxazole-2-yl)pyridin-3-yl]acetamide

HCID 66879643
New noteNew reactionRequest quotes
Print preview
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
CC(=O)Nc1cnccc1-c1nc2cc(C(F)(F)F)ccc2o1
InChIKey
WSAPVSUDFWKRSO-UHFFFAOYSA-N
Molecular formula
C15H10F3N3O2
Average molar mass
321.25 g/mol
Monoisotopic mass
321.07251106

Names & identifiers

Preferred name
N-[4-(5-trifluoromethylbenzoxazole-2-yl)pyridin-3-yl]acetamide
IUPAC
N-[4-[5-(trifluoromethyl)-1,3-benzoxazol-2-yl]-3-pyridinyl]acetamide

Names & synonyms

N-[4-(5-trifluoromethylbenzoxazole-2-yl)pyridin-3-yl]acetamideSCHEMBL1023206

Database identifiers

PubChem CID
66879643

Properties

Computed structural properties

XLogP
2.4
Topological polar surface area
68 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
7
Rotatable bonds
2
Heavy atoms
23
Formal charge
0
Complexity
446

Related reactions

5 records
New reaction record
HRID 884894 reaction equation
HRID 884894As productuspto-grants-2012_08
HRID 1913657 reaction equation
HRID 1913657As productuspto-grants-2013_12
HRID 2094410 reaction equation
HRID 2094410As productuspto-grants-2013_05
HRID 2190769 reaction equation
HRID 2190769As productuspto-grants-2012_12
HRID 2323040 reaction equation
HRID 2323040As productTraining data from https://doi.org/10.1039/C8SC04228D (10/10)

Compound notes

Loading…

On this pageBasic informationNames & identifiersPropertiesRelated reactionsCompound notes
More actions
New noteNew reactionRequest quotes