About [(3-methylphenyl)-quinolin-8-ylmethyl]hydrazine
[(3-methylphenyl)-quinolin-8-ylmethyl]hydrazine (PubChem CID 105200639) has the molecular formula C17H17N3
and a molecular weight of 263.34 g/mol. Its IUPAC name is [(3-methylphenyl)-quinolin-8-ylmethyl]hydrazine.
Molecular Properties
| Compound Name | [(3-methylphenyl)-quinolin-8-ylmethyl]hydrazine |
| PubChem CID | 105200639 |
| Molecular Formula | C17H17N3 |
| Molecular Weight | 263.34 g/mol |
| Exact Mass | 263.14 |
| IUPAC Name | [(3-methylphenyl)-quinolin-8-ylmethyl]hydrazine |
| SMILES | Cc1cccc(C(NN)c2cccc3cccnc23)c1 |
| InChI | InChI=1S/C17H17N3/c1-12-5-2-7-14(11-12)17(20-18)15-9-3-6-13-8-4-10-19-16(13)15/h2-11,17,20H,18H2,1H3 |
| InChIKey | HWKKOLXWAOAKGC-UHFFFAOYSA-N |
| XLogP | 3.10 |
| TPSA | 50.94 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 20 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 263.34 |
| LogP ≤ 5 | 3.10 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 3 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'hydrazine', '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 [(3-methylphenyl)-quinolin-8-ylmethyl]hydrazine?
The IUPAC name of [(3-methylphenyl)-quinolin-8-ylmethyl]hydrazine (CID 105200639) is [(3-methylphenyl)-quinolin-8-ylmethyl]hydrazine.
What is the SMILES notation for [(3-methylphenyl)-quinolin-8-ylmethyl]hydrazine?
The canonical SMILES for [(3-methylphenyl)-quinolin-8-ylmethyl]hydrazine is Cc1cccc(C(NN)c2cccc3cccnc23)c1.
What is the InChIKey of [(3-methylphenyl)-quinolin-8-ylmethyl]hydrazine?
The InChIKey is HWKKOLXWAOAKGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17N3/c1-12-5-2-7-14(11-12)17(20-18)15-9-3-6-13-8-4-10-19-16(13)15/h2-11,17,20H,18H2,1H3.
What are the key properties of [(3-methylphenyl)-quinolin-8-ylmethyl]hydrazine?
[(3-methylphenyl)-quinolin-8-ylmethyl]hydrazine has a molecular weight of 263.34 g/mol, XLogP of 3.10, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(3-methylphenyl)-quinolin-8-ylmethyl]hydrazine is sourced from PubChem (CID 105200639), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).