| CAS Number | 1000933-31-2 |
| Catalog Number | AG019LJL |
| Chemical Name | N-[(pyridin-3-yl)methyl]aminosulfonamide |
| IUPAC Name | 3-[(sulfamoylamino)methyl]pyridine |
| InChI | InChI=1S/C6H9N3O2S/c7-12(10,11)9-5-6-2-1-3-8-4-6/h1-4,9H,5H2,(H2,7,10,11) |
| InChI Key | VGICHQWDAIZSLB-UHFFFAOYSA-N |
| MDL Number | MFCD09971496 |
| Molecular Formula | C6H9N3O2S |
| Molecular Weight | 187.2196 |
| SMILES | NS(NCC1=CN=CC=C1)(=O)=O |
| Synonyms | N-(pyridin-3-ylmethyl)sulfamide,
N-(pyridin-3-ylmethyl)aminosulfonamide,
1000933-31-2,
AC1Q55HH,
SCHEMBL14380633,
CTK7F2180,
ZINC20282299,
AKOS009161071,
MCULE-9214189366,
NE38846,
N-[(pyridin-3-yl)methyl]aminosulfonamide,
EN300-31484,
Z300110264,
|
| Complexity | 221 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 187.042g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 12 |
| Hydrogen Bond Acceptor Count | 5 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 187.217g/mol |
| Monoisotopic Mass | 187.042g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 93.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | -0.9 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number