| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 2nd, 2009 | 16 | Yes |
Popular Name: 2-(4-Methyl-piperidin-1-yl)-2-phenyl-ethylamine 2-(4-Methyl-piperidin-1-yl)-2-ph…
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CAS Numbers: 889939-97-3 , [889939-97-3]
2-(4-methylpiperidin-1-yl)-2-phenylethan-1-amine
2-(4-methylpiperidin-1-yl)-2-phenylethanamine
| Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
|---|---|---|---|---|---|---|---|---|---|---|
| Ref Reference (pH 7) | 1.88 | 6.82 | -117.01 | 4 | 2 | 2 | 32 | 220.36 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.88 | 4.66 | -44.15 | 3 | 2 | 1 | 31 | 219.352 | 3 | ↓ |
| Hi High (pH 8-9.5) | 1.88 | 7.09 | -28.26 | 3 | 2 | 1 | 30 | 219.352 | 3 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Warnings | IRRITANT | Matrix Scientific |
