About 6-chloro-7-methyl-2-phenylquinoxaline
6-chloro-7-methyl-2-phenylquinoxaline (PubChem CID 102434799) has the molecular formula C15H11ClN2
and a molecular weight of 254.72 g/mol. Its IUPAC name is 6-chloro-7-methyl-2-phenylquinoxaline.
Molecular Properties
| Compound Name | 6-chloro-7-methyl-2-phenylquinoxaline |
| PubChem CID | 102434799 |
| Molecular Formula | C15H11ClN2 |
| Molecular Weight | 254.72 g/mol |
| Exact Mass | 254.06 |
| IUPAC Name | 6-chloro-7-methyl-2-phenylquinoxaline |
| SMILES | Cc1cc2nc(-c3ccccc3)cnc2cc1Cl |
| InChI | InChI=1S/C15H11ClN2/c1-10-7-14-13(8-12(10)16)17-9-15(18-14)11-5-3-2-4-6-11/h2-9H,1H3 |
| InChIKey | MARBGSCZZBIADZ-UHFFFAOYSA-N |
| XLogP | 4.26 |
| TPSA | 25.78 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Heavy Atoms | 18 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 254.72 |
| LogP ≤ 5 | 4.26 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 2 |
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Frequently Asked Questions
What is the IUPAC name of 6-chloro-7-methyl-2-phenylquinoxaline?
The IUPAC name of 6-chloro-7-methyl-2-phenylquinoxaline (CID 102434799) is 6-chloro-7-methyl-2-phenylquinoxaline.
What is the SMILES notation for 6-chloro-7-methyl-2-phenylquinoxaline?
The canonical SMILES for 6-chloro-7-methyl-2-phenylquinoxaline is Cc1cc2nc(-c3ccccc3)cnc2cc1Cl.
What is the InChIKey of 6-chloro-7-methyl-2-phenylquinoxaline?
The InChIKey is MARBGSCZZBIADZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11ClN2/c1-10-7-14-13(8-12(10)16)17-9-15(18-14)11-5-3-2-4-6-11/h2-9H,1H3.
What are the key properties of 6-chloro-7-methyl-2-phenylquinoxaline?
6-chloro-7-methyl-2-phenylquinoxaline has a molecular weight of 254.72 g/mol, XLogP of 4.26, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-7-methyl-2-phenylquinoxaline is sourced from PubChem (CID 102434799), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).