6-(1-methylpyrazol-4-yl)-1H-indazole

C11H10N4 — CID 118917376

IUPAC6-(1-methylpyrazol-4-yl)-1H-indazole
SMILESCn1cc(-c2ccc3cn[nH]c3c2)cn1
InChIInChI=1S/C11H10N4/c1-15-7-10(6-13-15)8-2-3-9-5-12-14-11(9)4-8/h2-7H,1H3,(H,12,14)
InChIKeySQHMXXKTQYXFRK-UHFFFAOYSA-N
MW198.23 g/mol
LogP1.96
Rot. Bonds1

About 6-(1-methylpyrazol-4-yl)-1H-indazole

6-(1-methylpyrazol-4-yl)-1H-indazole (PubChem CID 118917376) has the molecular formula C11H10N4 and a molecular weight of 198.23 g/mol. Its IUPAC name is 6-(1-methylpyrazol-4-yl)-1H-indazole.

Molecular Properties

Compound Name6-(1-methylpyrazol-4-yl)-1H-indazole
PubChem CID118917376
Molecular FormulaC11H10N4
Molecular Weight198.23 g/mol
Exact Mass198.09
IUPAC Name6-(1-methylpyrazol-4-yl)-1H-indazole
SMILESCn1cc(-c2ccc3cn[nH]c3c2)cn1
InChIInChI=1S/C11H10N4/c1-15-7-10(6-13-15)8-2-3-9-5-12-14-11(9)4-8/h2-7H,1H3,(H,12,14)
InChIKeySQHMXXKTQYXFRK-UHFFFAOYSA-N
XLogP1.96
TPSA46.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.23
LogP ≤ 51.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-(1-methylpyrazol-4-yl)-1H-indazole?
The IUPAC name of 6-(1-methylpyrazol-4-yl)-1H-indazole (CID 118917376) is 6-(1-methylpyrazol-4-yl)-1H-indazole.
What is the SMILES notation for 6-(1-methylpyrazol-4-yl)-1H-indazole?
The canonical SMILES for 6-(1-methylpyrazol-4-yl)-1H-indazole is Cn1cc(-c2ccc3cn[nH]c3c2)cn1.
What is the InChIKey of 6-(1-methylpyrazol-4-yl)-1H-indazole?
The InChIKey is SQHMXXKTQYXFRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10N4/c1-15-7-10(6-13-15)8-2-3-9-5-12-14-11(9)4-8/h2-7H,1H3,(H,12,14).
What are the key properties of 6-(1-methylpyrazol-4-yl)-1H-indazole?
6-(1-methylpyrazol-4-yl)-1H-indazole has a molecular weight of 198.23 g/mol, XLogP of 1.96, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(1-methylpyrazol-4-yl)-1H-indazole is sourced from PubChem (CID 118917376), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).