C11H8N4 — CID 137352887
2-(5-amino-2-pyridinyl)pyridine-4-carbonitrile (PubChem CID 137352887) has the molecular formula C11H8N4 and a molecular weight of 196.21 g/mol. Its IUPAC name is 2-(5-amino-2-pyridinyl)pyridine-4-carbonitrile.
| Compound Name | 2-(5-amino-2-pyridinyl)pyridine-4-carbonitrile |
|---|---|
| PubChem CID | 137352887 |
| Molecular Formula | C11H8N4 |
| Molecular Weight | 196.21 g/mol |
| Exact Mass | 196.07 |
| IUPAC Name | 2-(5-amino-2-pyridinyl)pyridine-4-carbonitrile |
| SMILES | N#Cc1ccnc(-c2ccc(N)cn2)c1 |
| InChI | InChI=1S/C11H8N4/c12-6-8-3-4-14-11(5-8)10-2-1-9(13)7-15-10/h1-5,7H,13H2 |
| InChIKey | LHSABUHYGGYFLS-UHFFFAOYSA-N |
| XLogP | 1.60 |
| TPSA | 75.59 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Heavy Atoms | 15 |
| Complexity | — |
Passes Rule of Five
| Rule | Value |
|---|---|
| MW ≤ 500 | 196.21 |
| LogP ≤ 5 | 1.60 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 4 |