2-[1-(6-methyl-2-pyridinyl)indazol-6-yl]pyrimidine-4-carbonitrile
C18H12N6 — CID 118664652
Data last refreshed: (MolForge compound catalog, from PubChem)
About 2-[1-(6-methyl-2-pyridinyl)indazol-6-yl]pyrimidine-4-carbonitrile
2-[1-(6-methyl-2-pyridinyl)indazol-6-yl]pyrimidine-4-carbonitrile (PubChem CID 118664652) has the molecular formula C18H12N6 and a molecular weight of 312.34 g/mol. Its IUPAC name is 2-[1-(6-methyl-2-pyridinyl)indazol-6-yl]pyrimidine-4-carbonitrile.
Molecular Properties
| Compound Name | 2-[1-(6-methyl-2-pyridinyl)indazol-6-yl]pyrimidine-4-carbonitrile |
|---|---|
| PubChem CID | 118664652 |
| Molecular Formula | C18H12N6 |
| Molecular Weight | 312.34 g/mol |
| Exact Mass | 312.11 |
| IUPAC Name | 2-[1-(6-methyl-2-pyridinyl)indazol-6-yl]pyrimidine-4-carbonitrile |
| SMILES | Cc1cccc(-n2ncc3ccc(-c4nccc(C#N)n4)cc32)n1 |
| InChI | InChI=1S/C18H12N6/c1-12-3-2-4-17(22-12)24-16-9-13(5-6-14(16)11-21-24)18-20-8-7-15(10-19)23-18/h2-9,11H,1H3 |
| InChIKey | QFPQTBHSNTWVON-UHFFFAOYSA-N |
| XLogP | 3.06 |
| TPSA | 80.28 Ų |
| H-Bond Donors | |
| H-Bond Acceptors | 6 |
| Rotatable Bonds | 2 |
| Heavy Atoms | 24 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
|---|---|
| MW ≤ 500 | 312.34 |
| LogP ≤ 5 | 3.06 |
| H-Bond Donors ≤ 5 | 0 |
| H-Bond Acceptors ≤ 10 | 6 |
Frequently Asked Questions
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Sources
- PubChem CID 118664652 — identifiers, structure, computed properties (public domain)
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