About 2-hydroxyphenanthrene-1-carbohydrazide
2-hydroxyphenanthrene-1-carbohydrazide (PubChem CID 87840739) has the molecular formula C15H12N2O2
and a molecular weight of 252.27 g/mol. Its IUPAC name is 2-hydroxyphenanthrene-1-carbohydrazide.
Molecular Properties
| Compound Name | 2-hydroxyphenanthrene-1-carbohydrazide |
| PubChem CID | 87840739 |
| Molecular Formula | C15H12N2O2 |
| Molecular Weight | 252.27 g/mol |
| Exact Mass | 252.09 |
| IUPAC Name | 2-hydroxyphenanthrene-1-carbohydrazide |
| SMILES | NNC(=O)c1c(O)ccc2c1ccc1ccccc12 |
| InChI | InChI=1S/C15H12N2O2/c16-17-15(19)14-12-6-5-9-3-1-2-4-10(9)11(12)7-8-13(14)18/h1-8,18H,16H2,(H,17,19) |
| InChIKey | SGTSYKLVUOARPK-UHFFFAOYSA-N |
| XLogP | 2.30 |
| TPSA | 75.35 Ų |
| H-Bond Donors | 3 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Heavy Atoms | 19 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 252.27 |
| LogP ≤ 5 | 2.30 |
| H-Bond Donors ≤ 5 | 3 |
| H-Bond Acceptors ≤ 10 | 3 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'acyl_hydrazine', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'} |
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Frequently Asked Questions
What is the IUPAC name of 2-hydroxyphenanthrene-1-carbohydrazide?
The IUPAC name of 2-hydroxyphenanthrene-1-carbohydrazide (CID 87840739) is 2-hydroxyphenanthrene-1-carbohydrazide.
What is the SMILES notation for 2-hydroxyphenanthrene-1-carbohydrazide?
The canonical SMILES for 2-hydroxyphenanthrene-1-carbohydrazide is NNC(=O)c1c(O)ccc2c1ccc1ccccc12.
What is the InChIKey of 2-hydroxyphenanthrene-1-carbohydrazide?
The InChIKey is SGTSYKLVUOARPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12N2O2/c16-17-15(19)14-12-6-5-9-3-1-2-4-10(9)11(12)7-8-13(14)18/h1-8,18H,16H2,(H,17,19).
What are the key properties of 2-hydroxyphenanthrene-1-carbohydrazide?
2-hydroxyphenanthrene-1-carbohydrazide has a molecular weight of 252.27 g/mol, XLogP of 2.30, 1 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxyphenanthrene-1-carbohydrazide is sourced from PubChem (CID 87840739), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).