| CAS Number | 1394042-62-6 |
| Catalog Number | AG019SOV(AGN-PC-0WOC3O) |
| Chemical Name | 3-ethyl-1-(propane-2-sulfonyl)piperidin-4-amine |
| IUPAC Name | 3-ethyl-1-propan-2-ylsulfonylpiperidin-4-amine |
| InChI | InChI=1S/C10H22N2O2S/c1-4-9-7-12(6-5-10(9)11)15(13,14)8(2)3/h8-10H,4-7,11H2,1-3H3 |
| InChI Key | MPOWBTRXNHFMAV-UHFFFAOYSA-N |
| MDL Number | MFCD22378806 |
| Molecular Formula | C10H22N2O2S |
| Molecular Weight | 234.3589 |
| SMILES | CCC1C(N)CCN(S(C(C)C)(=O)=O)C1 |
| Synonyms | 3-ethyl-1-(propane-2-sulfonyl)piperidin-4-amine,
1394042-62-6,
AKOS017568839,
MCULE-9644278335,
NE22737,
Z1428018975,
3-ethyl-1-(propane-2-sulfonyl)piperidin-4-amine, Mixture of diastereomers,
|
| Complexity | 295 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 234.14g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 4 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 234.358g/mol |
| Monoisotopic Mass | 234.14g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 71.8A^2 |
| Undefined Atom Stereocenter Count | 2 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.7 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number