| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 22nd, 2008 | 13 | Yes |
Popular Name: N,N,N'-Trimethyl-N'-piperidin-4-yl-ethane-1,2-diamine N,N,N'-Trimethyl-N'-piperidin-4-…
Find On: PubMed — Wikipedia — Google
CAS Numbers: 1185304-79-3 , 889940-14-1 , [889940-14-1]
'N,N,N''-Trimethyl-N''-piperidin-4-yl-ethane-1,2-diamine'
N,N,N'-trimethyl-N'-4-piperidinyl-1,2-ethanediamine trihydrochloride
N,N,N'-trimethyl-N'-4-piperidinyl-1,2-ethanediamine tri[(2Z)-2-butenedioate]
N,N,N'-Trimethyl-N'-piperidin-4-yl-ethane-1,2-diamine trihydrochloride
N,N,N'-trimethyl-N'-piperidin-4-ylethane-1,2-diamine
N~1~,N~1~,N~2~-trimethyl-N~2~-(4-piperidinyl)-1,2-ethanediamine trihydrochloride
| 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) | 0.20 | 3.11 | -83.97 | 3 | 3 | 2 | 24 | 187.331 | 4 | ↓ |
| Hi High (pH 8-9.5) | 0.20 | 0.64 | -37.81 | 2 | 3 | 1 | 23 | 186.323 | 4 | ↓ |
| Mid Mid (pH 6-8) | 0.20 | 4.05 | -104.07 | 3 | 3 | 2 | 21 | 187.331 | 4 | ↓ |
| Note Type | Comments | Provided By |
|---|---|---|
| Warnings | IRRITANT | Matrix Scientific |
| PUBCHEM_PATENT_ID | US5618814 | IBM Patent Data |
