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Details

Stereochemistry ACHIRAL
Molecular Formula C12H13FN2O
Molecular Weight 220.2428
Optical Activity NONE
Defined Stereocenters 0 / 0
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of 2-(1,2-Diazabicyclo[2.2.2]oct-2-en-3-yl)-5-fluorophenol

SMILES

OC1=CC(F)=CC=C1C2=NN3CCC2CC3

InChI

InChIKey=JYFOHKMHUHTVCN-UHFFFAOYSA-N
InChI=1S/C12H13FN2O/c13-9-1-2-10(11(16)7-9)12-8-3-5-15(14-12)6-4-8/h1-2,7-8,16H,3-6H2

HIDE SMILES / InChI

Molecular Formula C12H13FN2O
Molecular Weight 220.2428
Charge 0
Count
Stereochemistry ACHIRAL
Additional Stereochemistry No
Defined Stereocenters 0 / 0
E/Z Centers 0
Optical Activity NONE

Approval Year

Substance Class Chemical
Created
by admin
on Wed Apr 02 06:30:34 GMT 2025
Edited
by admin
on Wed Apr 02 06:30:34 GMT 2025
Record UNII
B4R26HW8VU
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
Phenol, 2-(1,2-diazabicyclo[2.2.2]oct-2-en-3-yl)-5-fluoro-
Preferred Name English
2-(1,2-Diazabicyclo[2.2.2]oct-2-en-3-yl)-5-fluorophenol
Systematic Name English
Code System Code Type Description
CAS
2733216-87-8
Created by admin on Wed Apr 02 06:30:34 GMT 2025 , Edited by admin on Wed Apr 02 06:30:34 GMT 2025
PRIMARY
FDA UNII
B4R26HW8VU
Created by admin on Wed Apr 02 06:30:34 GMT 2025 , Edited by admin on Wed Apr 02 06:30:34 GMT 2025
PRIMARY
PUBCHEM
168429465
Created by admin on Wed Apr 02 06:30:34 GMT 2025 , Edited by admin on Wed Apr 02 06:30:34 GMT 2025
PRIMARY