5-fluoro-4-methyl-1H-indazol-6-ol

C8H7FN2O — CID 163233375

IUPAC5-fluoro-4-methyl-1H-indazol-6-ol
SMILESCc1c(F)c(O)cc2[nH]ncc12
InChIInChI=1S/C8H7FN2O/c1-4-5-3-10-11-6(5)2-7(12)8(4)9/h2-3,12H,1H3,(H,10,11)
InChIKeyJOQRDVUJDLZQPU-UHFFFAOYSA-N
MW166.15 g/mol
LogP1.72
Rot. Bonds

About 5-fluoro-4-methyl-1H-indazol-6-ol

5-fluoro-4-methyl-1H-indazol-6-ol (PubChem CID 163233375) has the molecular formula C8H7FN2O and a molecular weight of 166.15 g/mol. Its IUPAC name is 5-fluoro-4-methyl-1H-indazol-6-ol.

Molecular Properties

Compound Name5-fluoro-4-methyl-1H-indazol-6-ol
PubChem CID163233375
Molecular FormulaC8H7FN2O
Molecular Weight166.15 g/mol
Exact Mass166.05
IUPAC Name5-fluoro-4-methyl-1H-indazol-6-ol
SMILESCc1c(F)c(O)cc2[nH]ncc12
InChIInChI=1S/C8H7FN2O/c1-4-5-3-10-11-6(5)2-7(12)8(4)9/h2-3,12H,1H3,(H,10,11)
InChIKeyJOQRDVUJDLZQPU-UHFFFAOYSA-N
XLogP1.72
TPSA48.91 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.15
LogP ≤ 51.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-fluoro-4-methyl-1H-indazol-6-ol?
The IUPAC name of 5-fluoro-4-methyl-1H-indazol-6-ol (CID 163233375) is 5-fluoro-4-methyl-1H-indazol-6-ol.
What is the SMILES notation for 5-fluoro-4-methyl-1H-indazol-6-ol?
The canonical SMILES for 5-fluoro-4-methyl-1H-indazol-6-ol is Cc1c(F)c(O)cc2[nH]ncc12.
What is the InChIKey of 5-fluoro-4-methyl-1H-indazol-6-ol?
The InChIKey is JOQRDVUJDLZQPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7FN2O/c1-4-5-3-10-11-6(5)2-7(12)8(4)9/h2-3,12H,1H3,(H,10,11).
What are the key properties of 5-fluoro-4-methyl-1H-indazol-6-ol?
5-fluoro-4-methyl-1H-indazol-6-ol has a molecular weight of 166.15 g/mol, XLogP of 1.72, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-4-methyl-1H-indazol-6-ol is sourced from PubChem (CID 163233375), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).