| CAS Number | 1383342-71-9 |
| Catalog Number | AG00HV99 |
| Chemical Name | TERT-BUTYL 4-(N-METHYLBENZAMIDO)PIPERIDINE-1-CARBOXYLATE |
| IUPAC Name | tert-butyl 4-[benzoyl(methyl)amino]piperidine-1-carboxylate |
| InChI | InChI=1S/C18H26N2O3/c1-18(2,3)23-17(22)20-12-10-15(11-13-20)19(4)16(21)14-8-6-5-7-9-14/h5-9,15H,10-13H2,1-4H3 |
| InChI Key | MQAXUJKDMYGIJR-UHFFFAOYSA-N |
| MDL Number | MFCD24390731 |
| Molecular Formula | C18H26N2O3 |
| Molecular Weight | 318.4106 |
| SMILES | CN(C(=O)c1ccccc1)C1CCN(CC1)C(=O)OC(C)(C)C |
| Synonyms | tert-Butyl 4-(N-methylbenzamido)piperidine-1-carboxylate,
1383342-71-9,
SCHEMBL9943184,
MQAXUJKDMYGIJR-UHFFFAOYSA-N,
MFCD24390731,
ZINC75454101,
AKOS027251693,
1,1-dimethylethyl 4-[methyl(phenylcarbonyl)amino]-1-piperidinecarboxylate,
|
| Complexity | 417 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 318.194g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 23 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 0 |
| Isotope Atom Count | 0 |
| Molecular Weight | 318.417g/mol |
| Monoisotopic Mass | 318.194g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 49.8A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.8 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number