About (3Z)-4-hydrazinylhexa-1,3,5-trien-3-amine
(3Z)-4-hydrazinylhexa-1,3,5-trien-3-amine (PubChem CID 139458329) has the molecular formula C6H11N3
and a molecular weight of 125.17 g/mol. Its IUPAC name is (3Z)-4-hydrazinylhexa-1,3,5-trien-3-amine.
Molecular Properties
| Compound Name | (3Z)-4-hydrazinylhexa-1,3,5-trien-3-amine |
| PubChem CID | 139458329 |
| Molecular Formula | C6H11N3 |
| Molecular Weight | 125.17 g/mol |
| Exact Mass | 125.10 |
| IUPAC Name | (3Z)-4-hydrazinylhexa-1,3,5-trien-3-amine |
| SMILES | C=C/C(N)=C(\C=C)NN |
| InChI | InChI=1S/C6H11N3/c1-3-5(7)6(4-2)9-8/h3-4,9H,1-2,7-8H2/b6-5- |
| InChIKey | DOHPQNVKKBIGHW-WAYWQWQTSA-N |
| XLogP | -0.01 |
| TPSA | 64.07 Ų |
| H-Bond Donors | 3 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 9 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 125.17 |
| LogP ≤ 5 | -0.01 |
| H-Bond Donors ≤ 5 | 3 |
| H-Bond Acceptors ≤ 10 | 3 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'polyene', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of (3Z)-4-hydrazinylhexa-1,3,5-trien-3-amine?
The IUPAC name of (3Z)-4-hydrazinylhexa-1,3,5-trien-3-amine (CID 139458329) is (3Z)-4-hydrazinylhexa-1,3,5-trien-3-amine.
What is the SMILES notation for (3Z)-4-hydrazinylhexa-1,3,5-trien-3-amine?
The canonical SMILES for (3Z)-4-hydrazinylhexa-1,3,5-trien-3-amine is C=C/C(N)=C(\C=C)NN.
What is the InChIKey of (3Z)-4-hydrazinylhexa-1,3,5-trien-3-amine?
The InChIKey is DOHPQNVKKBIGHW-WAYWQWQTSA-N. The full InChI is InChI=1S/C6H11N3/c1-3-5(7)6(4-2)9-8/h3-4,9H,1-2,7-8H2/b6-5-.
What are the key properties of (3Z)-4-hydrazinylhexa-1,3,5-trien-3-amine?
(3Z)-4-hydrazinylhexa-1,3,5-trien-3-amine has a molecular weight of 125.17 g/mol, XLogP of -0.01, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3Z)-4-hydrazinylhexa-1,3,5-trien-3-amine is sourced from PubChem (CID 139458329), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).