5-fluoro-4-(1-methylpyrazol-4-yl)-1H-indazol-7-ol

C11H9FN4O — CID 156845663

IUPAC5-fluoro-4-(1-methylpyrazol-4-yl)-1H-indazol-7-ol
SMILESCn1cc(-c2c(F)cc(O)c3[nH]ncc23)cn1
InChIInChI=1S/C11H9FN4O/c1-16-5-6(3-14-16)10-7-4-13-15-11(7)9(17)2-8(10)12/h2-5,17H,1H3,(H,13,15)
InChIKeyFSIWNYCJYZTXNK-UHFFFAOYSA-N
MW232.22 g/mol
LogP1.81
Rot. Bonds1

About 5-fluoro-4-(1-methylpyrazol-4-yl)-1H-indazol-7-ol

5-fluoro-4-(1-methylpyrazol-4-yl)-1H-indazol-7-ol (PubChem CID 156845663) has the molecular formula C11H9FN4O and a molecular weight of 232.22 g/mol. Its IUPAC name is 5-fluoro-4-(1-methylpyrazol-4-yl)-1H-indazol-7-ol.

Molecular Properties

Compound Name5-fluoro-4-(1-methylpyrazol-4-yl)-1H-indazol-7-ol
PubChem CID156845663
Molecular FormulaC11H9FN4O
Molecular Weight232.22 g/mol
Exact Mass232.08
IUPAC Name5-fluoro-4-(1-methylpyrazol-4-yl)-1H-indazol-7-ol
SMILESCn1cc(-c2c(F)cc(O)c3[nH]ncc23)cn1
InChIInChI=1S/C11H9FN4O/c1-16-5-6(3-14-16)10-7-4-13-15-11(7)9(17)2-8(10)12/h2-5,17H,1H3,(H,13,15)
InChIKeyFSIWNYCJYZTXNK-UHFFFAOYSA-N
XLogP1.81
TPSA66.73 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.22
LogP ≤ 51.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-fluoro-4-(1-methylpyrazol-4-yl)-1H-indazol-7-ol?
The IUPAC name of 5-fluoro-4-(1-methylpyrazol-4-yl)-1H-indazol-7-ol (CID 156845663) is 5-fluoro-4-(1-methylpyrazol-4-yl)-1H-indazol-7-ol.
What is the SMILES notation for 5-fluoro-4-(1-methylpyrazol-4-yl)-1H-indazol-7-ol?
The canonical SMILES for 5-fluoro-4-(1-methylpyrazol-4-yl)-1H-indazol-7-ol is Cn1cc(-c2c(F)cc(O)c3[nH]ncc23)cn1.
What is the InChIKey of 5-fluoro-4-(1-methylpyrazol-4-yl)-1H-indazol-7-ol?
The InChIKey is FSIWNYCJYZTXNK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9FN4O/c1-16-5-6(3-14-16)10-7-4-13-15-11(7)9(17)2-8(10)12/h2-5,17H,1H3,(H,13,15).
What are the key properties of 5-fluoro-4-(1-methylpyrazol-4-yl)-1H-indazol-7-ol?
5-fluoro-4-(1-methylpyrazol-4-yl)-1H-indazol-7-ol has a molecular weight of 232.22 g/mol, XLogP of 1.81, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-4-(1-methylpyrazol-4-yl)-1H-indazol-7-ol is sourced from PubChem (CID 156845663), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).