| Catalog Number | ACM68712629 |
| CAS | 68712-62-9 |
| IUPAC Name | 1-(4-phenylpiperidin-4-yl)butan-1-one |
| Synonyms | 1-(4-phenylpiperidin-4-yl)butan-1-one;68712-62-9;4-butyryl-4-phenylpiperidine;SCHEMBL4261726;ZINC393573;1-(4-Phenyl-4-piperidinyl)-1-butanone |
| Molecular Weight | 231.33g/mol |
| Molecular Formula | C15H21NO |
| Canonical SMILES | CCCC(=O)C1(CCNCC1)C2=CC=CC=C2 |
| InChI | InChI=1S/C15H21NO/c1-2-6-14(17)15(9-11-16-12-10-15)13-7-4-3-5-8-13/h3-5,7-8,16H,2,6,9-12H2,1H3 |
| InChI Key | QXFLUZNRIHBZHA-UHFFFAOYSA-N |
| Complexity | 250 |
| Covalently-Bonded Unit Count | 1 |
| Exact Mass | 231.162314293g/mol |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 2 |
| Monoisotopic Mass | 231.162314293g/mol |
| Rotatable Bond Count | 4 |
| Topological Polar Surface Area | 29.1Ų |
| X Log P3 | 2.3 |