| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 3rd, 2005 | 9 | Yes |
Popular Name: Nipecotamide Nipecotamide
Find On: PubMed — Wikipedia — Google
CAS Numbers: 1019852-04-0 , 1026661-43-7 , 1214903-21-5 , 4138-26-5 , 828300-58-9 , 88495-55-0 , 98-92-0 , [4138-26-5] , [828300-58-9]
(R)-Piperidine-3-carboxamidehydrochloride
(S)-PIPERIDINE-3-CARBOXAMIDE HYDROCHLORIDE
(S)-Piperidine-3-carboxylic acid amide
3-piperidinecarboxamide hydrochloride
3-piperidinecarboxamide, monohydrochloride
3-piperidinecarboxamide; 4138-26-5; nsc523303
3-piperidinecarboxamidehydrochloride
| 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) | -0.75 | -0.9 | -48.41 | 4 | 3 | 1 | 60 | 129.183 | 1 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Mp [°C] | 102 - 108 | Acros Organics |
| MP | 103 - 106 | Enamine Building Blocks |
| MP | 103-105° | Oakwood Chemical |
| MP | 111 | TCI |
| MP | 263 - 265 | Enamine Building Blocks |
| MP | 263...265 | Enamine Building Blocks |
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Purity | 95% | Fluorochem |
| Purity | 95+% | Matrix Scientific |
| Purity | 98% | Fluorochem |
| Warnings | IRRITANT | Matrix Scientific |
| S phrase | S24/25: Avoid contact with skin and eyes. | Acros Organics |
No pre-computed analogs available. Try a structural similarity search.