| CAS Number | 1016778-72-5 |
| Catalog Number | AG01A8RP |
| Chemical Name | 3-[(5-aminopyridin-2-yl)oxy]benzamide |
| IUPAC Name | 3-(5-aminopyridin-2-yl)oxybenzamide |
| InChI | InChI=1S/C12H11N3O2/c13-9-4-5-11(15-7-9)17-10-3-1-2-8(6-10)12(14)16/h1-7H,13H2,(H2,14,16) |
| InChI Key | KUPPDXHQCBVXEL-UHFFFAOYSA-N |
| MDL Number | MFCD09933308 |
| Molecular Formula | C12H11N3O2 |
| Molecular Weight | 229.2346 |
| SMILES | NC(C1=CC(OC2=NC=C(N)C=C2)=CC=C1)=O |
| Synonyms | 3-[(5-aminopyridin-2-yl)oxy]benzamide,
1016778-72-5,
EN300-62394,
AC1Q4ZB5,
ZINC19437478,
AKOS000175010,
MCULE-1944498830,
NE21264,
SEL11314168,
Z992717276,
|
| Complexity | 273 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 229.085g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 229.239g/mol |
| Monoisotopic Mass | 229.085g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 91.2A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.9 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number