About tetradec-7-ene-1,14-diamine
tetradec-7-ene-1,14-diamine (PubChem CID 91430908) has the molecular formula C14H30N2
and a molecular weight of 226.41 g/mol. Its IUPAC name is tetradec-7-ene-1,14-diamine.
Molecular Properties
| Compound Name | tetradec-7-ene-1,14-diamine |
| PubChem CID | 91430908 |
| Molecular Formula | C14H30N2 |
| Molecular Weight | 226.41 g/mol |
| Exact Mass | 226.24 |
| IUPAC Name | tetradec-7-ene-1,14-diamine |
| SMILES | NCCCCCCC=CCCCCCCN |
| InChI | InChI=1S/C14H30N2/c15-13-11-9-7-5-3-1-2-4-6-8-10-12-14-16/h1-2H,3-16H2 |
| InChIKey | GSLLSEJIPJZLCQ-UHFFFAOYSA-N |
| XLogP | 3.36 |
| TPSA | 52.04 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 12 |
| Heavy Atoms | 16 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 226.41 |
| LogP ≤ 5 | 3.36 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 2 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of tetradec-7-ene-1,14-diamine?
The IUPAC name of tetradec-7-ene-1,14-diamine (CID 91430908) is tetradec-7-ene-1,14-diamine.
What is the SMILES notation for tetradec-7-ene-1,14-diamine?
The canonical SMILES for tetradec-7-ene-1,14-diamine is NCCCCCCC=CCCCCCCN.
What is the InChIKey of tetradec-7-ene-1,14-diamine?
The InChIKey is GSLLSEJIPJZLCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30N2/c15-13-11-9-7-5-3-1-2-4-6-8-10-12-14-16/h1-2H,3-16H2.
What are the key properties of tetradec-7-ene-1,14-diamine?
tetradec-7-ene-1,14-diamine has a molecular weight of 226.41 g/mol, XLogP of 3.36, 12 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for tetradec-7-ene-1,14-diamine is sourced from PubChem (CID 91430908), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).