About N'-butyl-N'-(2-phenylphenyl)propanehydrazide
N'-butyl-N'-(2-phenylphenyl)propanehydrazide (PubChem CID 110180034) has the molecular formula C19H24N2O
and a molecular weight of 296.41 g/mol. Its IUPAC name is N'-butyl-N'-(2-phenylphenyl)propanehydrazide.
Molecular Properties
| Compound Name | N'-butyl-N'-(2-phenylphenyl)propanehydrazide |
| PubChem CID | 110180034 |
| Molecular Formula | C19H24N2O |
| Molecular Weight | 296.41 g/mol |
| Exact Mass | 296.19 |
| IUPAC Name | N'-butyl-N'-(2-phenylphenyl)propanehydrazide |
| SMILES | CCCCN(NC(=O)CC)c1ccccc1-c1ccccc1 |
| InChI | InChI=1S/C19H24N2O/c1-3-5-15-21(20-19(22)4-2)18-14-10-9-13-17(18)16-11-7-6-8-12-16/h6-14H,3-5,15H2,1-2H3,(H,20,22) |
| InChIKey | KTNMGIAMVNYEIW-UHFFFAOYSA-N |
| XLogP | 4.40 |
| TPSA | 32.34 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 7 |
| Heavy Atoms | 22 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 296.41 |
| LogP ≤ 5 | 4.40 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 2 |
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 N'-butyl-N'-(2-phenylphenyl)propanehydrazide?
The IUPAC name of N'-butyl-N'-(2-phenylphenyl)propanehydrazide (CID 110180034) is N'-butyl-N'-(2-phenylphenyl)propanehydrazide.
What is the SMILES notation for N'-butyl-N'-(2-phenylphenyl)propanehydrazide?
The canonical SMILES for N'-butyl-N'-(2-phenylphenyl)propanehydrazide is CCCCN(NC(=O)CC)c1ccccc1-c1ccccc1.
What is the InChIKey of N'-butyl-N'-(2-phenylphenyl)propanehydrazide?
The InChIKey is KTNMGIAMVNYEIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O/c1-3-5-15-21(20-19(22)4-2)18-14-10-9-13-17(18)16-11-7-6-8-12-16/h6-14H,3-5,15H2,1-2H3,(H,20,22).
What are the key properties of N'-butyl-N'-(2-phenylphenyl)propanehydrazide?
N'-butyl-N'-(2-phenylphenyl)propanehydrazide has a molecular weight of 296.41 g/mol, XLogP of 4.40, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-butyl-N'-(2-phenylphenyl)propanehydrazide is sourced from PubChem (CID 110180034), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).