About N'-methyl-3-(4-phenylphenyl)propanehydrazide
N'-methyl-3-(4-phenylphenyl)propanehydrazide (PubChem CID 116846347) has the molecular formula C16H18N2O
and a molecular weight of 254.33 g/mol. Its IUPAC name is N'-methyl-3-(4-phenylphenyl)propanehydrazide.
Molecular Properties
| Compound Name | N'-methyl-3-(4-phenylphenyl)propanehydrazide |
| PubChem CID | 116846347 |
| Molecular Formula | C16H18N2O |
| Molecular Weight | 254.33 g/mol |
| Exact Mass | 254.14 |
| IUPAC Name | N'-methyl-3-(4-phenylphenyl)propanehydrazide |
| SMILES | CNNC(=O)CCc1ccc(-c2ccccc2)cc1 |
| InChI | InChI=1S/C16H18N2O/c1-17-18-16(19)12-9-13-7-10-15(11-8-13)14-5-3-2-4-6-14/h2-8,10-11,17H,9,12H2,1H3,(H,18,19) |
| InChIKey | PFPCNOMGWJJTDY-UHFFFAOYSA-N |
| XLogP | 2.54 |
| TPSA | 41.13 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Heavy Atoms | 19 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 254.33 |
| LogP ≤ 5 | 2.54 |
| H-Bond Donors ≤ 5 | 2 |
| 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'-methyl-3-(4-phenylphenyl)propanehydrazide?
The IUPAC name of N'-methyl-3-(4-phenylphenyl)propanehydrazide (CID 116846347) is N'-methyl-3-(4-phenylphenyl)propanehydrazide.
What is the SMILES notation for N'-methyl-3-(4-phenylphenyl)propanehydrazide?
The canonical SMILES for N'-methyl-3-(4-phenylphenyl)propanehydrazide is CNNC(=O)CCc1ccc(-c2ccccc2)cc1.
What is the InChIKey of N'-methyl-3-(4-phenylphenyl)propanehydrazide?
The InChIKey is PFPCNOMGWJJTDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O/c1-17-18-16(19)12-9-13-7-10-15(11-8-13)14-5-3-2-4-6-14/h2-8,10-11,17H,9,12H2,1H3,(H,18,19).
What are the key properties of N'-methyl-3-(4-phenylphenyl)propanehydrazide?
N'-methyl-3-(4-phenylphenyl)propanehydrazide has a molecular weight of 254.33 g/mol, XLogP of 2.54, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-methyl-3-(4-phenylphenyl)propanehydrazide is sourced from PubChem (CID 116846347), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).