5-(1-methylpyrazol-4-yl)-1H-pyrazolo[3,4-b]pyridine

C10H9N5 — CID 66555776

IUPAC5-(1-methylpyrazol-4-yl)-1H-pyrazolo[3,4-b]pyridine
SMILESCn1cc(-c2cnc3[nH]ncc3c2)cn1
InChIInChI=1S/C10H9N5/c1-15-6-9(5-13-15)7-2-8-4-12-14-10(8)11-3-7/h2-6H,1H3,(H,11,12,14)
InChIKeyJSZXOLQTINVYKX-UHFFFAOYSA-N
MW199.22 g/mol
LogP1.36
Rot. Bonds1

About 5-(1-methylpyrazol-4-yl)-1H-pyrazolo[3,4-b]pyridine

5-(1-methylpyrazol-4-yl)-1H-pyrazolo[3,4-b]pyridine (PubChem CID 66555776) has the molecular formula C10H9N5 and a molecular weight of 199.22 g/mol. Its IUPAC name is 5-(1-methylpyrazol-4-yl)-1H-pyrazolo[3,4-b]pyridine.

Molecular Properties

Compound Name5-(1-methylpyrazol-4-yl)-1H-pyrazolo[3,4-b]pyridine
PubChem CID66555776
Molecular FormulaC10H9N5
Molecular Weight199.22 g/mol
Exact Mass199.09
IUPAC Name5-(1-methylpyrazol-4-yl)-1H-pyrazolo[3,4-b]pyridine
SMILESCn1cc(-c2cnc3[nH]ncc3c2)cn1
InChIInChI=1S/C10H9N5/c1-15-6-9(5-13-15)7-2-8-4-12-14-10(8)11-3-7/h2-6H,1H3,(H,11,12,14)
InChIKeyJSZXOLQTINVYKX-UHFFFAOYSA-N
XLogP1.36
TPSA59.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500199.22
LogP ≤ 51.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-(1-methylpyrazol-4-yl)-1H-pyrazolo[3,4-b]pyridine?
The IUPAC name of 5-(1-methylpyrazol-4-yl)-1H-pyrazolo[3,4-b]pyridine (CID 66555776) is 5-(1-methylpyrazol-4-yl)-1H-pyrazolo[3,4-b]pyridine.
What is the SMILES notation for 5-(1-methylpyrazol-4-yl)-1H-pyrazolo[3,4-b]pyridine?
The canonical SMILES for 5-(1-methylpyrazol-4-yl)-1H-pyrazolo[3,4-b]pyridine is Cn1cc(-c2cnc3[nH]ncc3c2)cn1.
What is the InChIKey of 5-(1-methylpyrazol-4-yl)-1H-pyrazolo[3,4-b]pyridine?
The InChIKey is JSZXOLQTINVYKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9N5/c1-15-6-9(5-13-15)7-2-8-4-12-14-10(8)11-3-7/h2-6H,1H3,(H,11,12,14).
What are the key properties of 5-(1-methylpyrazol-4-yl)-1H-pyrazolo[3,4-b]pyridine?
5-(1-methylpyrazol-4-yl)-1H-pyrazolo[3,4-b]pyridine has a molecular weight of 199.22 g/mol, XLogP of 1.36, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(1-methylpyrazol-4-yl)-1H-pyrazolo[3,4-b]pyridine is sourced from PubChem (CID 66555776), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).