| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 8th, 2008 | 9 | Yes |
Popular Name: 2-Pyrrolidin-1-yl-propylamine 2-Pyrrolidin-1-yl-propylamine
Find On: PubMed — Wikipedia — Google
CAS Numbers: 50998-07-7 , [50998-07-7]
(2-pyrrolidin-1-ylpropyl)amine
2-(1-pyrrolidinyl)-1-propanamine
2-(pyrrolidin-1-yl)propan-1-amine
| 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) | -0.12 | 2.52 | -106.37 | 4 | 2 | 2 | 32 | 130.235 | 2 | ↓ |
| Hi High (pH 8-9.5) | -0.12 | 2.17 | -28.69 | 3 | 2 | 1 | 30 | 129.227 | 2 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| purity | 9.500000000000000e+001 | Enamine Building Blocks Enamine Building Blocks |
| Purity | 95% | Fluorochem |
| PUBCHEM_PATENT_ID | EP0518216A2; EP0518216A3 | IBM Patent Data |
| Warnings | IRRITANT | Matrix Scientific |
No pre-computed analogs available. Try a structural similarity search.