About 1-(2-methylundecan-2-yl)-2-naphthalen-1-yl-1-phenylhydrazine
1-(2-methylundecan-2-yl)-2-naphthalen-1-yl-1-phenylhydrazine (PubChem CID 175042996) has the molecular formula C28H38N2
and a molecular weight of 402.63 g/mol. Its IUPAC name is 1-(2-methylundecan-2-yl)-2-naphthalen-1-yl-1-phenylhydrazine.
Molecular Properties
| Compound Name | 1-(2-methylundecan-2-yl)-2-naphthalen-1-yl-1-phenylhydrazine |
| PubChem CID | 175042996 |
| Molecular Formula | C28H38N2 |
| Molecular Weight | 402.63 g/mol |
| Exact Mass | 402.30 |
| IUPAC Name | 1-(2-methylundecan-2-yl)-2-naphthalen-1-yl-1-phenylhydrazine |
| SMILES | CCCCCCCCCC(C)(C)N(Nc1cccc2ccccc12)c1ccccc1 |
| InChI | InChI=1S/C28H38N2/c1-4-5-6-7-8-9-15-23-28(2,3)30(25-19-11-10-12-20-25)29-27-22-16-18-24-17-13-14-21-26(24)27/h10-14,16-22,29H,4-9,15,23H2,1-3H3 |
| InChIKey | NRDYWZRKCCWKRG-UHFFFAOYSA-N |
| XLogP | 8.59 |
| TPSA | 15.27 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 12 |
| Heavy Atoms | 30 |
| Complexity | — |
Lipinski Rule of Five
1 violation
| Rule | Value |
| MW ≤ 500 | 402.63 |
| LogP ≤ 5 | 8.59 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 2 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'Aliphatic_long_chain', '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 1-(2-methylundecan-2-yl)-2-naphthalen-1-yl-1-phenylhydrazine?
The IUPAC name of 1-(2-methylundecan-2-yl)-2-naphthalen-1-yl-1-phenylhydrazine (CID 175042996) is 1-(2-methylundecan-2-yl)-2-naphthalen-1-yl-1-phenylhydrazine.
What is the SMILES notation for 1-(2-methylundecan-2-yl)-2-naphthalen-1-yl-1-phenylhydrazine?
The canonical SMILES for 1-(2-methylundecan-2-yl)-2-naphthalen-1-yl-1-phenylhydrazine is CCCCCCCCCC(C)(C)N(Nc1cccc2ccccc12)c1ccccc1.
What is the InChIKey of 1-(2-methylundecan-2-yl)-2-naphthalen-1-yl-1-phenylhydrazine?
The InChIKey is NRDYWZRKCCWKRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H38N2/c1-4-5-6-7-8-9-15-23-28(2,3)30(25-19-11-10-12-20-25)29-27-22-16-18-24-17-13-14-21-26(24)27/h10-14,16-22,29H,4-9,15,23H2,1-3H3.
What are the key properties of 1-(2-methylundecan-2-yl)-2-naphthalen-1-yl-1-phenylhydrazine?
1-(2-methylundecan-2-yl)-2-naphthalen-1-yl-1-phenylhydrazine has a molecular weight of 402.63 g/mol, XLogP of 8.59, 12 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methylundecan-2-yl)-2-naphthalen-1-yl-1-phenylhydrazine is sourced from PubChem (CID 175042996), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).