| CAS Number | 2080399-34-2 |
| Catalog Number | AG01E829 |
| Chemical Name | {[(2R)-1-benzylpiperidin-2-yl]methyl}(methyl)amine |
| IUPAC Name | 1-(1-benzylpiperidin-2-yl)-N-methylmethanamine |
| InChI | InChI=1S/C14H22N2/c1-15-11-14-9-5-6-10-16(14)12-13-7-3-2-4-8-13/h2-4,7-8,14-15H,5-6,9-12H2,1H3 |
| InChI Key | OMJZRIGOKXUQEC-UHFFFAOYSA-N |
| MDL Number | MFCD30537730 |
| Molecular Formula | C14H22N2 |
| Molecular Weight | 218.3379 |
| SMILES | CNC[C@@H]1N(CC2=CC=CC=C2)CCCC1 |
| Synonyms | (1-Benzyl-piperidin-2-ylmethyl)-methyl-amine,
274671-67-9,
1-(1-Benzylpiperidin-2-yl)-N-methylmethanamine,
SCHEMBL7454601,
AKOS010833131,
(1-benzylpiperidin-2-ylmethyl)methylamine,
AM100611,
{[(2R)-1-benzylpiperidin-2-yl]methyl}(methyl)amine,
2080399-34-2,
CID9794440,
1-(1-benzyl-2-piperidyl)-N-methyl-methanamine,
|
| Complexity | 187 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 218.178g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 218.344g/mol |
| Monoisotopic Mass | 218.178g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 15.3A^2 |
| Undefined Atom Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.2 |
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Certificate of Analysis
Lot Number