| CAS Number | 1354953-53-9 |
| Catalog Number | AG01AL0Q |
| Chemical Name | N-{2-[Benzyl(methyl)amino]ethyl}piperidine-4-carboxamide |
| IUPAC Name | N-[2-[benzyl(methyl)amino]ethyl]piperidine-4-carboxamide |
| InChI | InChI=1S/C16H25N3O/c1-19(13-14-5-3-2-4-6-14)12-11-18-16(20)15-7-9-17-10-8-15/h2-6,15,17H,7-13H2,1H3,(H,18,20) |
| InChI Key | BUZUNLFPRMWKDM-UHFFFAOYSA-N |
| MDL Number | MFCD20233659 |
| Molecular Formula | C16H25N3O |
| Molecular Weight | 275.3892 |
| SMILES | CN(CC1=CC=CC=C1)CCNC(C1CCNCC1)=O |
| Synonyms | N-{2-[benzyl(methyl)amino]ethyl}piperidine-4-carboxamide,
1354953-53-9,
ZINC71372517,
MCULE-1898165415,
NE49017,
EN300-85961,
Z1259161643,
|
| Complexity | 283 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 275.2g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 20 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 275.396g/mol |
| Monoisotopic Mass | 275.2g/mol |
| Rotatable Bond Count | 6 |
| Topological Polar Surface Area | 44.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.1 |
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Certificate of Analysis
Lot Number