N-(furan-2-ylmethyl)propan-1-amine | SBID = 554 | Compound | Custom Molecule
Structure
Molecular Properties
| Interactions: | 2 | ||
| PubChem TPSA/Å2: | |||
| Ertl TPSA/Å2: | |||
| Hydrophilicity (PubChem XLogP): | |||
| Hydrophilicity (Cheng XLogP3): | |||
| Charge: | 0.0 | ||
| Number of H-Bond Donors: | |||
| Number of H-Bond Acceptors: | |||
| Number of Stereogenic Bonds (E/Z): | |||
| Number of Stereogenic Atoms (R/S): | |||
| 3D Volume/Å3: | |||
| Sum Formula: | C8H13NO | ||
| M / g/mol: | 139.2 | ||
| Complexity: | |||
| Number of Conformers: |
Identifiers
- Tags: typical guest
- Name: N-(furan-2-ylmethyl)propan-1-amine
- Preferred Abbreviation: N-(furanylmethyl)propanamine
- IUPAC Name: N-(furan-2-ylmethyl)propan-1-amine
- CAS: 39191-12-3
- CID: -127
- InChiKey: LPPWAQZJYMWSHG-UHFFFAOYSA-N
- InChi: InChI=1S/C8H13NO/c1-2-5-9-7-8-4-3-6-10-8/h3-4,6,9H,2,5,7H2,1H3
- CanoSmiles: CCCNCC1=CC=CO1
- IsoSmiles: CCCNCC1=CC=CO1
