About (E)-5-hydrazinyl-N-methylpent-3-en-1-amine
(E)-5-hydrazinyl-N-methylpent-3-en-1-amine (PubChem CID 134505070) has the molecular formula C6H15N3
and a molecular weight of 129.20 g/mol. Its IUPAC name is (E)-5-hydrazinyl-N-methylpent-3-en-1-amine.
Molecular Properties
| Compound Name | (E)-5-hydrazinyl-N-methylpent-3-en-1-amine |
| PubChem CID | 134505070 |
| Molecular Formula | C6H15N3 |
| Molecular Weight | 129.20 g/mol |
| Exact Mass | 129.13 |
| IUPAC Name | (E)-5-hydrazinyl-N-methylpent-3-en-1-amine |
| SMILES | CNCC/C=C/CNN |
| InChI | InChI=1S/C6H15N3/c1-8-5-3-2-4-6-9-7/h2,4,8-9H,3,5-7H2,1H3/b4-2+ |
| InChIKey | ZWFPRCZPVOTNBF-DUXPYHPUSA-N |
| XLogP | -0.60 |
| TPSA | 50.10 Ų |
| H-Bond Donors | 3 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Heavy Atoms | 9 |
| Complexity | 70 |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 129.20 |
| LogP ≤ 5 | -0.60 |
| H-Bond Donors ≤ 5 | 3 |
| H-Bond Acceptors ≤ 10 | 3 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of (E)-5-hydrazinyl-N-methylpent-3-en-1-amine?
The IUPAC name of (E)-5-hydrazinyl-N-methylpent-3-en-1-amine (CID 134505070) is (E)-5-hydrazinyl-N-methylpent-3-en-1-amine.
What is the SMILES notation for (E)-5-hydrazinyl-N-methylpent-3-en-1-amine?
The canonical SMILES for (E)-5-hydrazinyl-N-methylpent-3-en-1-amine is CNCC/C=C/CNN.
What is the InChIKey of (E)-5-hydrazinyl-N-methylpent-3-en-1-amine?
The InChIKey is ZWFPRCZPVOTNBF-DUXPYHPUSA-N. The full InChI is InChI=1S/C6H15N3/c1-8-5-3-2-4-6-9-7/h2,4,8-9H,3,5-7H2,1H3/b4-2+.
What are the key properties of (E)-5-hydrazinyl-N-methylpent-3-en-1-amine?
(E)-5-hydrazinyl-N-methylpent-3-en-1-amine has a molecular weight of 129.20 g/mol, XLogP of -0.60, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-5-hydrazinyl-N-methylpent-3-en-1-amine is sourced from PubChem (CID 134505070), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).