About N-fluoroprop-2-en-1-amine;hydroiodide
N-fluoroprop-2-en-1-amine;hydroiodide (PubChem CID 173029959) has the molecular formula C3H7FIN
and a molecular weight of 203.00 g/mol. Its IUPAC name is N-fluoroprop-2-en-1-amine;hydroiodide.
Molecular Properties
| Compound Name | N-fluoroprop-2-en-1-amine;hydroiodide |
| PubChem CID | 173029959 |
| Molecular Formula | C3H7FIN |
| Molecular Weight | 203.00 g/mol |
| Exact Mass | 202.96 |
| IUPAC Name | N-fluoroprop-2-en-1-amine;hydroiodide |
| SMILES | C=CCNF.I |
| InChI | InChI=1S/C3H6FN.HI/c1-2-3-5-4;/h2,5H,1,3H2;1H |
| InChIKey | YIQOOVNFGZJXQF-UHFFFAOYSA-N |
| XLogP | 1.26 |
| TPSA | 12.03 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 6 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 203.00 |
| LogP ≤ 5 | 1.26 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 1 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'iodine', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}, {'alert_name': 'N-halo', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of N-fluoroprop-2-en-1-amine;hydroiodide?
The IUPAC name of N-fluoroprop-2-en-1-amine;hydroiodide (CID 173029959) is N-fluoroprop-2-en-1-amine;hydroiodide.
What is the SMILES notation for N-fluoroprop-2-en-1-amine;hydroiodide?
The canonical SMILES for N-fluoroprop-2-en-1-amine;hydroiodide is C=CCNF.I.
What is the InChIKey of N-fluoroprop-2-en-1-amine;hydroiodide?
The InChIKey is YIQOOVNFGZJXQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H6FN.HI/c1-2-3-5-4;/h2,5H,1,3H2;1H.
What are the key properties of N-fluoroprop-2-en-1-amine;hydroiodide?
N-fluoroprop-2-en-1-amine;hydroiodide has a molecular weight of 203.00 g/mol, XLogP of 1.26, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-fluoroprop-2-en-1-amine;hydroiodide is sourced from PubChem (CID 173029959), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).