| CAS Number | 157368-33-7 |
| Catalog Number | AG01BA7J |
| Chemical Name | 2-(4-Benzylpiperazin-1-yl)-N-methylethan-1-amine |
| IUPAC Name | 2-(4-benzylpiperazin-1-yl)-N-methylethanamine |
| InChI | InChI=1S/C14H23N3/c1-15-7-8-16-9-11-17(12-10-16)13-14-5-3-2-4-6-14/h2-6,15H,7-13H2,1H3 |
| InChI Key | OHXXFNDRWMGSGD-UHFFFAOYSA-N |
| MDL Number | MFCD10697869 |
| Molecular Formula | C14H23N3 |
| Molecular Weight | 233.3525 |
| SMILES | CNCCN1CCN(CC2=CC=CC=C2)CC1 |
| Synonyms | 2-(4-benzylpiperazin-1-yl)-N-methylethan-1-amine,
131502-30-2,
SCHEMBL6957735,
CTK8G7988,
ZINC19685486,
AKOS000257348,
AB60693,
2-(4-BENZYLPIPERAZIN-1-YL)-N-METHYLETHANAMINE,
[2-(4-BENZYLPIPERAZIN-1-YL)ETHYL](METHYL)AMINE,
F2163-0147,
157368-33-7,
CID10704815,
2-(4-benzylpiperazin-1-yl)-N-methyl-ethanamine,
|
| Complexity | 194 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 233.189g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 1 |
| Isotope Atom Count | 0 |
| Molecular Weight | 233.359g/mol |
| Monoisotopic Mass | 233.189g/mol |
| Rotatable Bond Count | 5 |
| Topological Polar Surface Area | 18.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 1.1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number