| CAS Number | 16168-15-3 |
| Catalog Number | AG01A94K |
| Chemical Name | 4-Benzylpiperidine-1-sulfonamide |
| IUPAC Name | 4-benzylpiperidine-1-sulfonamide |
| InChI | InChI=1S/C12H18N2O2S/c13-17(15,16)14-8-6-12(7-9-14)10-11-4-2-1-3-5-11/h1-5,12H,6-10H2,(H2,13,15,16) |
| InChI Key | GHHLZJXJNUPZCT-UHFFFAOYSA-N |
| MDL Number | MFCD11644030 |
| Molecular Formula | C12H18N2O2S |
| Molecular Weight | 254.3485 |
| SMILES | NS(N1CCC(CC2=CC=CC=C2)CC1)(=O)=O |
| Synonyms | 4-benzylpiperidine-1-sulfonamide,
16168-15-3,
AC1Q55H0,
ZINC37389994,
AKOS009161069,
MCULE-9983007064,
NE23607,
EN300-64168,
Z300109660,
|
| Complexity | 323 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 254.109g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 254.348g/mol |
| Monoisotopic Mass | 254.109g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 71.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.5 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number