About N-(6-methyl-3-pyridinyl)-2-pyridin-4-ylacetamide
N-(6-methyl-3-pyridinyl)-2-pyridin-4-ylacetamide (PubChem CID 112532425) has the molecular formula C13H13N3O
and a molecular weight of 227.27 g/mol. Its IUPAC name is N-(6-methyl-3-pyridinyl)-2-pyridin-4-ylacetamide.
Molecular Properties
| Compound Name | N-(6-methyl-3-pyridinyl)-2-pyridin-4-ylacetamide |
| PubChem CID | 112532425 |
| Molecular Formula | C13H13N3O |
| Molecular Weight | 227.27 g/mol |
| Exact Mass | 227.11 |
| IUPAC Name | N-(6-methyl-3-pyridinyl)-2-pyridin-4-ylacetamide |
| SMILES | Cc1ccc(NC(=O)Cc2ccncc2)cn1 |
| InChI | InChI=1S/C13H13N3O/c1-10-2-3-12(9-15-10)16-13(17)8-11-4-6-14-7-5-11/h2-7,9H,8H2,1H3,(H,16,17) |
| InChIKey | FKZFSTSWYPDWQO-UHFFFAOYSA-N |
| XLogP | 1.97 |
| TPSA | 54.88 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 17 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 227.27 |
| LogP ≤ 5 | 1.97 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 3 |
Analyze N-(6-methyl-3-pyridinyl)-2-pyridin-4-ylacetamide 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-(6-methyl-3-pyridinyl)-2-pyridin-4-ylacetamide?
The IUPAC name of N-(6-methyl-3-pyridinyl)-2-pyridin-4-ylacetamide (CID 112532425) is N-(6-methyl-3-pyridinyl)-2-pyridin-4-ylacetamide.
What is the SMILES notation for N-(6-methyl-3-pyridinyl)-2-pyridin-4-ylacetamide?
The canonical SMILES for N-(6-methyl-3-pyridinyl)-2-pyridin-4-ylacetamide is Cc1ccc(NC(=O)Cc2ccncc2)cn1.
What is the InChIKey of N-(6-methyl-3-pyridinyl)-2-pyridin-4-ylacetamide?
The InChIKey is FKZFSTSWYPDWQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13N3O/c1-10-2-3-12(9-15-10)16-13(17)8-11-4-6-14-7-5-11/h2-7,9H,8H2,1H3,(H,16,17).
What are the key properties of N-(6-methyl-3-pyridinyl)-2-pyridin-4-ylacetamide?
N-(6-methyl-3-pyridinyl)-2-pyridin-4-ylacetamide has a molecular weight of 227.27 g/mol, XLogP of 1.97, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-methyl-3-pyridinyl)-2-pyridin-4-ylacetamide is sourced from PubChem (CID 112532425), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).