| CAS Number | 223786-50-3 |
| Catalog Number | AG00BKT0(AGN-PC-0166IX) |
| Chemical Name | 1-(4-Aminophenyl)piperidine-4-carboxamide |
| IUPAC Name | 1-(4-aminophenyl)piperidine-4-carboxamide |
| InChI | InChI=1S/C12H17N3O/c13-10-1-3-11(4-2-10)15-7-5-9(6-8-15)12(14)16/h1-4,9H,5-8,13H2,(H2,14,16) |
| InChI Key | SXFSOZCNRLOVFG-UHFFFAOYSA-N |
| MDL Number | MFCD09737672 |
| Molecular Formula | C12H17N3O |
| Molecular Weight | 219.2829 |
| SMILES | NC(C1CCN(C2=CC=C(N)C=C2)CC1)=O |
| Synonyms | 1-(4-aminophenyl)piperidine-4-carboxamide,
223786-50-3,
EN300-61334,
AC1Q4ZIT,
SCHEMBL77188,
CTK7D2890,
DTXSID90588549,
ZINC22218861,
AKOS000147621,
MCULE-7030156610,
BC4150154,
4-Piperidinecarboxamide, 1-(4-aminophenyl)-,
VU0494923-1,
L-2721,
1-(4-Aminophenyl)piperidine-4-carboxamide, AldrichCPR,
F2190-0679,
Z1262250867,
|
| Complexity | 241 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 1 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 219.137g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 16 |
| Hydrogen Bond Acceptor Count | 3 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 219.288g/mol |
| Monoisotopic Mass | 219.137g/mol |
| Rotatable Bond Count | 2 |
| Topological Polar Surface Area | 72.4A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| XLogP3 | 0.7 |
GHS Hazard and Precautionary Statements
Certificate of Analysis
Lot Number