About 2-phenoxy-N'-(1-phenylpent-1-enyl)acetohydrazide
2-phenoxy-N'-(1-phenylpent-1-enyl)acetohydrazide (PubChem CID 5086970) has the molecular formula C19H22N2O2
and a molecular weight of 310.40 g/mol. Its IUPAC name is 2-phenoxy-N'-(1-phenylpent-1-enyl)acetohydrazide.
Molecular Properties
| Compound Name | 2-phenoxy-N'-(1-phenylpent-1-enyl)acetohydrazide |
| PubChem CID | 5086970 |
| Molecular Formula | C19H22N2O2 |
| Molecular Weight | 310.40 g/mol |
| Exact Mass | 310.17 |
| IUPAC Name | 2-phenoxy-N'-(1-phenylpent-1-enyl)acetohydrazide |
| SMILES | CCCC=C(NNC(=O)COc1ccccc1)c1ccccc1 |
| InChI | InChI=1S/C19H22N2O2/c1-2-3-14-18(16-10-6-4-7-11-16)20-21-19(22)15-23-17-12-8-5-9-13-17/h4-14,20H,2-3,15H2,1H3,(H,21,22) |
| InChIKey | UQIXESJWVCTIBT-UHFFFAOYSA-N |
| XLogP | 3.53 |
| TPSA | 50.36 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 8 |
| Heavy Atoms | 23 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 310.40 |
| LogP ≤ 5 | 3.53 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 3 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of 2-phenoxy-N'-(1-phenylpent-1-enyl)acetohydrazide?
The IUPAC name of 2-phenoxy-N'-(1-phenylpent-1-enyl)acetohydrazide (CID 5086970) is 2-phenoxy-N'-(1-phenylpent-1-enyl)acetohydrazide.
What is the SMILES notation for 2-phenoxy-N'-(1-phenylpent-1-enyl)acetohydrazide?
The canonical SMILES for 2-phenoxy-N'-(1-phenylpent-1-enyl)acetohydrazide is CCCC=C(NNC(=O)COc1ccccc1)c1ccccc1.
What is the InChIKey of 2-phenoxy-N'-(1-phenylpent-1-enyl)acetohydrazide?
The InChIKey is UQIXESJWVCTIBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O2/c1-2-3-14-18(16-10-6-4-7-11-16)20-21-19(22)15-23-17-12-8-5-9-13-17/h4-14,20H,2-3,15H2,1H3,(H,21,22).
What are the key properties of 2-phenoxy-N'-(1-phenylpent-1-enyl)acetohydrazide?
2-phenoxy-N'-(1-phenylpent-1-enyl)acetohydrazide has a molecular weight of 310.40 g/mol, XLogP of 3.53, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenoxy-N'-(1-phenylpent-1-enyl)acetohydrazide is sourced from PubChem (CID 5086970), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).