N'-(3-aminopropyl)butane-1,4-diamine | SBID = 2632 | Compound |
Structure
Molecular Properties
| Interactions: | 1 | ||
| PubChem TPSA/Å2: | 64.1 | ||
| Ertl TPSA/Å2: | 64.07 | ||
| Hydrophilicity (PubChem XLogP): | -1.0 | ||
| Hydrophilicity (Cheng XLogP3): | -1.01 | ||
| Charge: | 0.0 | ||
| Number of H-Bond Donors: | 3.0 | ||
| Number of H-Bond Acceptors: | 3.0 | ||
| Number of Stereogenic Bonds (E/Z): | 0.0 | ||
| Number of Stereogenic Atoms (R/S): | 0.0 | ||
| 3D Volume/Å3: | 122.5 | ||
| Sum Formula: | C7H19N3 | ||
| M / g/mol: | 145.25 | ||
| Complexity: | 56.0 | ||
| Number of Conformers: | 10.0 |
Identifiers
- Tags: typical guest
- Name: N'-(3-aminopropyl)butane-1,4-diamine
- Preferred Abbreviation: spermidine
- IUPAC Name: N'-(3-aminopropyl)butane-1,4-diamine
- CAS:
- CID: 1102
- InChiKey: ATHGHQPFGPMSJY-UHFFFAOYSA-N
- InChi: InChI=1S/C7H19N3/c8-4-1-2-6-10-7-3-5-9/h10H,1-9H2
- CanoSmiles: C(CCNCCCN)CN
- IsoSmiles: C(CCNCCCN)CN
