| CAS Number | 71207-29-9 |
| Catalog Number | AG00IC5K(AGN-PC-00GTUZ) |
| Chemical Name | N-Benzylidene(piperidin-4-yl)methanamine |
| IUPAC Name | 1-phenyl-N-(piperidin-4-ylmethyl)methanimine |
| InChI | InChI=1S/C13H18N2/c1-2-4-12(5-3-1)10-15-11-13-6-8-14-9-7-13/h1-5,10,13-14H,6-9,11H2 |
| InChI Key | OTYCRQJZOXMPSK-UHFFFAOYSA-N |
| MDL Number | MFCD16620786 |
| Molecular Formula | C13H18N2 |
| Molecular Weight | 202.2954 |
| SMILES | N1CCC(CC1)C/N=C/c1ccccc1 |
| Synonyms | N-Benzylidene(piperidin-4-yl)methanamine,
71207-29-9,
N-Benzylidene-1-(piperidin-4-yl)methanamine,
SCHEMBL1406071,
SCHEMBL1406072,
OTYCRQJZOXMPSK-UHFFFAOYSA-N,
OTYCRQJZOXMPSK-XNTDXEJSSA-N,
N-benzylidene-4-piperidylmethylamine,
MFCD16620786,
ZINC36459604,
benzylidene-piperidin-4-ylmethyl-amine,
N-benzylidene-1-(4-piperidyl)methylamine,
(E)-N-benzylidene-1-(piperidin-4-yl)methanamine,
N-[phenylmethylidene]-1-(piperidin-4-yl)methanamine,
N-hexahydro-4-pyridylmethyl-N-phenylmethylideneamine,
N-hexahydro-4-pyridinylmethyl-N-phenylmethylidenamine,
N-hexahydro-4-pyridinylmethyl-N-phenylmethylidene-amine,
CID11820173,
1-phenyl-N-(4-piperidylmethyl)methanimine,
|
| Complexity | 189 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 202.147g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 15 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 202.301g/mol |
| Monoisotopic Mass | 202.147g/mol |
| Rotatable Bond Count | 3 |
| Topological Polar Surface Area | 24.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.8 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number