C12H13N3OS — CID 61292956
N-(5-amino-4-methyl-2-pyridinyl)-5-methylthiophene-2-carboxamide (PubChem CID 61292956) has the molecular formula C12H13N3OS and a molecular weight of 247.32 g/mol. Its IUPAC name is N-(5-amino-4-methyl-2-pyridinyl)-5-methylthiophene-2-carboxamide.
| Compound Name | N-(5-amino-4-methyl-2-pyridinyl)-5-methylthiophene-2-carboxamide |
|---|---|
| PubChem CID | 61292956 |
| Molecular Formula | C12H13N3OS |
| Molecular Weight | 247.32 g/mol |
| Exact Mass | 247.08 |
| IUPAC Name | N-(5-amino-4-methyl-2-pyridinyl)-5-methylthiophene-2-carboxamide |
| SMILES | Cc1ccc(C(=O)Nc2cc(C)c(N)cn2)s1 |
| InChI | InChI=1S/C12H13N3OS/c1-7-5-11(14-6-9(7)13)15-12(16)10-4-3-8(2)17-10/h3-6H,13H2,1-2H3,(H,14,15,16) |
| InChIKey | KMKWVPPZOLTKLF-UHFFFAOYSA-N |
| XLogP | 2.59 |
| TPSA | 68.01 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 17 |
| Complexity | — |
Passes Rule of Five
| Rule | Value |
|---|---|
| MW ≤ 500 | 247.32 |
| LogP ≤ 5 | 2.59 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 4 |