About 6-(2-methoxy-5-methylphenyl)pyridine-3-carboxamide
6-(2-methoxy-5-methylphenyl)pyridine-3-carboxamide (PubChem CID 56701713) has the molecular formula C14H14N2O2
and a molecular weight of 242.28 g/mol. Its IUPAC name is 6-(2-methoxy-5-methylphenyl)pyridine-3-carboxamide.
Molecular Properties
| Compound Name | 6-(2-methoxy-5-methylphenyl)pyridine-3-carboxamide |
| PubChem CID | 56701713 |
| Molecular Formula | C14H14N2O2 |
| Molecular Weight | 242.28 g/mol |
| Exact Mass | 242.11 |
| IUPAC Name | 6-(2-methoxy-5-methylphenyl)pyridine-3-carboxamide |
| SMILES | COc1ccc(C)cc1-c1ccc(C(N)=O)cn1 |
| InChI | InChI=1S/C14H14N2O2/c1-9-3-6-13(18-2)11(7-9)12-5-4-10(8-16-12)14(15)17/h3-8H,1-2H3,(H2,15,17) |
| InChIKey | IQPCHZLVOIEQSC-UHFFFAOYSA-N |
| XLogP | 2.16 |
| TPSA | 65.21 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 18 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 242.28 |
| LogP ≤ 5 | 2.16 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of 6-(2-methoxy-5-methylphenyl)pyridine-3-carboxamide?
The IUPAC name of 6-(2-methoxy-5-methylphenyl)pyridine-3-carboxamide (CID 56701713) is 6-(2-methoxy-5-methylphenyl)pyridine-3-carboxamide.
What is the SMILES notation for 6-(2-methoxy-5-methylphenyl)pyridine-3-carboxamide?
The canonical SMILES for 6-(2-methoxy-5-methylphenyl)pyridine-3-carboxamide is COc1ccc(C)cc1-c1ccc(C(N)=O)cn1.
What is the InChIKey of 6-(2-methoxy-5-methylphenyl)pyridine-3-carboxamide?
The InChIKey is IQPCHZLVOIEQSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14N2O2/c1-9-3-6-13(18-2)11(7-9)12-5-4-10(8-16-12)14(15)17/h3-8H,1-2H3,(H2,15,17).
What are the key properties of 6-(2-methoxy-5-methylphenyl)pyridine-3-carboxamide?
6-(2-methoxy-5-methylphenyl)pyridine-3-carboxamide has a molecular weight of 242.28 g/mol, XLogP of 2.16, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-methoxy-5-methylphenyl)pyridine-3-carboxamide is sourced from PubChem (CID 56701713), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).