| CAS Number | 1224932-55-1 |
| Catalog Number | AG00AA26 |
| Chemical Name | 4-{4-[(Dimethylamino)methyl]piperidin-1-yl}aniline |
| IUPAC Name | 4-[4-[(dimethylamino)methyl]piperidin-1-yl]aniline |
| InChI | InChI=1S/C14H23N3/c1-16(2)11-12-7-9-17(10-8-12)14-5-3-13(15)4-6-14/h3-6,12H,7-11,15H2,1-2H3 |
| InChI Key | RQZFRKKVDQQMAD-UHFFFAOYSA-N |
| MDL Number | MFCD16251975 |
| Molecular Formula | C14H23N3 |
| Molecular Weight | 233.3525 |
| SMILES | CN(CC1CCN(C2=CC=C(N)C=C2)CC1)C |
| Synonyms | 1224932-55-1,
4-{4-[(dimethylamino)methyl]piperidin-1-yl}aniline,
4-(4-((Dimethylamino)methyl)piperidin-1-yl)aniline,
SCHEMBL3567979,
RQZFRKKVDQQMAD-UHFFFAOYSA-N,
ZINC58945855,
AKOS006145828,
MCULE-2137957010,
NE26230,
EN300-82092,
4-(4-dimethylaminomethyl-piperidin-1-yl)-phenylamine,
Z1235963388,
4-{4-[(Dimethylamino)methyl]piperidin-1-yl},
|
| Complexity | 214 |
| 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 | 3 |
| Topological Polar Surface Area | 32.5A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 2.1 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number