7-fluoro-4-methoxy-3-propan-2-yl-2H-indazole

C₁₁H₁₃FN₂O — CID 142719046

About 7-fluoro-4-methoxy-3-propan-2-yl-2H-indazole

7-fluoro-4-methoxy-3-propan-2-yl-2H-indazole (PubChem CID 142719046) has the molecular formula C₁₁H₁₃FN₂O and a molecular weight of 208.24 g/mol. Its IUPAC name is 7-fluoro-4-methoxy-3-propan-2-yl-2H-indazole.

Molecular Properties

• Compound Name: 7-fluoro-4-methoxy-3-propan-2-yl-2H-indazole
• PubChem CID: 142719046
• Molecular Formula: C₁₁H₁₃FN₂O
• Molecular Weight: 208.24 g/mol
• Exact Mass: 208.10
• IUPAC Name: 7-fluoro-4-methoxy-3-propan-2-yl-2H-indazole
• SMILES: COc1ccc(F)c2n[nH]c(C(C)C)c12
• InChI: InChI=1S/C11H13FN2O/c1-6(2)10-9-8(15-3)5-4-7(12)11(9)14-13-10/h4-6H,1-3H3,(H,13,14)
• InChIKey: GUJBGDQZFRDYKJ-UHFFFAOYSA-N
• XLogP: 2.83
• TPSA: 37.91 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 2
• Rotatable Bonds: 2
• Heavy Atoms: 15
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	208.24
LogP ≤ 5	2.83
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	2

Frequently Asked Questions

What is the IUPAC name of 7-fluoro-4-methoxy-3-propan-2-yl-2H-indazole?

The IUPAC name of 7-fluoro-4-methoxy-3-propan-2-yl-2H-indazole (CID 142719046) is 7-fluoro-4-methoxy-3-propan-2-yl-2H-indazole.

What is the SMILES notation for 7-fluoro-4-methoxy-3-propan-2-yl-2H-indazole?

The canonical SMILES for 7-fluoro-4-methoxy-3-propan-2-yl-2H-indazole is COc1ccc(F)c2n[nH]c(C(C)C)c12.

What is the InChIKey of 7-fluoro-4-methoxy-3-propan-2-yl-2H-indazole?

The InChIKey is GUJBGDQZFRDYKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13FN2O/c1-6(2)10-9-8(15-3)5-4-7(12)11(9)14-13-10/h4-6H,1-3H3,(H,13,14).

What are the key properties of 7-fluoro-4-methoxy-3-propan-2-yl-2H-indazole?

7-fluoro-4-methoxy-3-propan-2-yl-2H-indazole has a molecular weight of 208.24 g/mol, XLogP of 2.83, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.

Where does this data come from?

All data for 7-fluoro-4-methoxy-3-propan-2-yl-2H-indazole is sourced from PubChem (CID 142719046), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Sources

• PubChem CID 142719046 — identifiers, structure, computed properties (public domain)

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