7-fluoro-4-methoxy-1H-indazole

C8H7FN2O — CID 59272977

IUPAC7-fluoro-4-methoxy-1H-indazole
SMILESCOc1ccc(F)c2[nH]ncc12
InChIInChI=1S/C8H7FN2O/c1-12-7-3-2-6(9)8-5(7)4-10-11-8/h2-4H,1H3,(H,10,11)
InChIKeyWENCVOVAKXHRIQ-UHFFFAOYSA-N
MW166.16 g/mol
LogP1.71
Rot. Bonds1

About 7-fluoro-4-methoxy-1H-indazole

7-fluoro-4-methoxy-1H-indazole (PubChem CID 59272977) has the molecular formula C8H7FN2O and a molecular weight of 166.16 g/mol. Its IUPAC name is 7-fluoro-4-methoxy-1H-indazole.

Molecular Properties

Compound Name7-fluoro-4-methoxy-1H-indazole
PubChem CID59272977
Molecular FormulaC8H7FN2O
Molecular Weight166.16 g/mol
Exact Mass166.05
IUPAC Name7-fluoro-4-methoxy-1H-indazole
SMILESCOc1ccc(F)c2[nH]ncc12
InChIInChI=1S/C8H7FN2O/c1-12-7-3-2-6(9)8-5(7)4-10-11-8/h2-4H,1H3,(H,10,11)
InChIKeyWENCVOVAKXHRIQ-UHFFFAOYSA-N
XLogP1.71
TPSA37.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.16
LogP ≤ 51.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 7-fluoro-4-methoxy-1H-indazole?
The IUPAC name of 7-fluoro-4-methoxy-1H-indazole (CID 59272977) is 7-fluoro-4-methoxy-1H-indazole.
What is the SMILES notation for 7-fluoro-4-methoxy-1H-indazole?
The canonical SMILES for 7-fluoro-4-methoxy-1H-indazole is COc1ccc(F)c2[nH]ncc12.
What is the InChIKey of 7-fluoro-4-methoxy-1H-indazole?
The InChIKey is WENCVOVAKXHRIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7FN2O/c1-12-7-3-2-6(9)8-5(7)4-10-11-8/h2-4H,1H3,(H,10,11).
What are the key properties of 7-fluoro-4-methoxy-1H-indazole?
7-fluoro-4-methoxy-1H-indazole has a molecular weight of 166.16 g/mol, XLogP of 1.71, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-fluoro-4-methoxy-1H-indazole is sourced from PubChem (CID 59272977), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).