About N-quinoxalin-5-ylquinoxalin-5-amine
N-quinoxalin-5-ylquinoxalin-5-amine (PubChem CID 2913620) has the molecular formula C16H11N5
and a molecular weight of 273.30 g/mol. Its IUPAC name is N-quinoxalin-5-ylquinoxalin-5-amine.
Molecular Properties
| Compound Name | N-quinoxalin-5-ylquinoxalin-5-amine |
| PubChem CID | 2913620 |
| Molecular Formula | C16H11N5 |
| Molecular Weight | 273.30 g/mol |
| Exact Mass | 273.10 |
| IUPAC Name | N-quinoxalin-5-ylquinoxalin-5-amine |
| SMILES | c1cc(Nc2cccc3nccnc23)c2nccnc2c1 |
| InChI | InChI=1S/C16H11N5/c1-3-11-15(19-9-7-17-11)13(5-1)21-14-6-2-4-12-16(14)20-10-8-18-12/h1-10,21H |
| InChIKey | MKQHDMUULHTBSD-UHFFFAOYSA-N |
| XLogP | 3.32 |
| TPSA | 63.59 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 5 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 21 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 273.30 |
| LogP ≤ 5 | 3.32 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 5 |
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Frequently Asked Questions
What is the IUPAC name of N-quinoxalin-5-ylquinoxalin-5-amine?
The IUPAC name of N-quinoxalin-5-ylquinoxalin-5-amine (CID 2913620) is N-quinoxalin-5-ylquinoxalin-5-amine.
What is the SMILES notation for N-quinoxalin-5-ylquinoxalin-5-amine?
The canonical SMILES for N-quinoxalin-5-ylquinoxalin-5-amine is c1cc(Nc2cccc3nccnc23)c2nccnc2c1.
What is the InChIKey of N-quinoxalin-5-ylquinoxalin-5-amine?
The InChIKey is MKQHDMUULHTBSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H11N5/c1-3-11-15(19-9-7-17-11)13(5-1)21-14-6-2-4-12-16(14)20-10-8-18-12/h1-10,21H.
What are the key properties of N-quinoxalin-5-ylquinoxalin-5-amine?
N-quinoxalin-5-ylquinoxalin-5-amine has a molecular weight of 273.30 g/mol, XLogP of 3.32, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-quinoxalin-5-ylquinoxalin-5-amine is sourced from PubChem (CID 2913620), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).