About N-(3-methylquinoxalin-5-yl)benzamide
N-(3-methylquinoxalin-5-yl)benzamide (PubChem CID 141198352) has the molecular formula C16H13N3O
and a molecular weight of 263.30 g/mol. Its IUPAC name is N-(3-methylquinoxalin-5-yl)benzamide.
Molecular Properties
| Compound Name | N-(3-methylquinoxalin-5-yl)benzamide |
| PubChem CID | 141198352 |
| Molecular Formula | C16H13N3O |
| Molecular Weight | 263.30 g/mol |
| Exact Mass | 263.11 |
| IUPAC Name | N-(3-methylquinoxalin-5-yl)benzamide |
| SMILES | Cc1cnc2cccc(NC(=O)c3ccccc3)c2n1 |
| InChI | InChI=1S/C16H13N3O/c1-11-10-17-13-8-5-9-14(15(13)18-11)19-16(20)12-6-3-2-4-7-12/h2-10H,1H3,(H,19,20) |
| InChIKey | JLLBJOKAXJTWHZ-UHFFFAOYSA-N |
| XLogP | 3.19 |
| TPSA | 54.88 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 20 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 263.30 |
| LogP ≤ 5 | 3.19 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 3 |
Analyze N-(3-methylquinoxalin-5-yl)benzamide with MolForge
Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.
Launch Full Analysis
Frequently Asked Questions
What is the IUPAC name of N-(3-methylquinoxalin-5-yl)benzamide?
The IUPAC name of N-(3-methylquinoxalin-5-yl)benzamide (CID 141198352) is N-(3-methylquinoxalin-5-yl)benzamide.
What is the SMILES notation for N-(3-methylquinoxalin-5-yl)benzamide?
The canonical SMILES for N-(3-methylquinoxalin-5-yl)benzamide is Cc1cnc2cccc(NC(=O)c3ccccc3)c2n1.
What is the InChIKey of N-(3-methylquinoxalin-5-yl)benzamide?
The InChIKey is JLLBJOKAXJTWHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13N3O/c1-11-10-17-13-8-5-9-14(15(13)18-11)19-16(20)12-6-3-2-4-7-12/h2-10H,1H3,(H,19,20).
What are the key properties of N-(3-methylquinoxalin-5-yl)benzamide?
N-(3-methylquinoxalin-5-yl)benzamide has a molecular weight of 263.30 g/mol, XLogP of 3.19, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-methylquinoxalin-5-yl)benzamide is sourced from PubChem (CID 141198352), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).