5-ethenyl-3-methyl-2H-pyrazolo[3,4-b]pyridine

C9H9N3 — CID 148629869

IUPAC5-ethenyl-3-methyl-2H-pyrazolo[3,4-b]pyridine
SMILESC=Cc1cnc2n[nH]c(C)c2c1
InChIInChI=1S/C9H9N3/c1-3-7-4-8-6(2)11-12-9(8)10-5-7/h3-5H,1H2,2H3,(H,10,11,12)
InChIKeyNHYAXZPQQFFGJQ-UHFFFAOYSA-N
MW159.19 g/mol
LogP1.91
Rot. Bonds1

About 5-ethenyl-3-methyl-2H-pyrazolo[3,4-b]pyridine

5-ethenyl-3-methyl-2H-pyrazolo[3,4-b]pyridine (PubChem CID 148629869) has the molecular formula C9H9N3 and a molecular weight of 159.19 g/mol. Its IUPAC name is 5-ethenyl-3-methyl-2H-pyrazolo[3,4-b]pyridine.

Molecular Properties

Compound Name5-ethenyl-3-methyl-2H-pyrazolo[3,4-b]pyridine
PubChem CID148629869
Molecular FormulaC9H9N3
Molecular Weight159.19 g/mol
Exact Mass159.08
IUPAC Name5-ethenyl-3-methyl-2H-pyrazolo[3,4-b]pyridine
SMILESC=Cc1cnc2n[nH]c(C)c2c1
InChIInChI=1S/C9H9N3/c1-3-7-4-8-6(2)11-12-9(8)10-5-7/h3-5H,1H2,2H3,(H,10,11,12)
InChIKeyNHYAXZPQQFFGJQ-UHFFFAOYSA-N
XLogP1.91
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500159.19
LogP ≤ 51.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-ethenyl-3-methyl-2H-pyrazolo[3,4-b]pyridine?
The IUPAC name of 5-ethenyl-3-methyl-2H-pyrazolo[3,4-b]pyridine (CID 148629869) is 5-ethenyl-3-methyl-2H-pyrazolo[3,4-b]pyridine.
What is the SMILES notation for 5-ethenyl-3-methyl-2H-pyrazolo[3,4-b]pyridine?
The canonical SMILES for 5-ethenyl-3-methyl-2H-pyrazolo[3,4-b]pyridine is C=Cc1cnc2n[nH]c(C)c2c1.
What is the InChIKey of 5-ethenyl-3-methyl-2H-pyrazolo[3,4-b]pyridine?
The InChIKey is NHYAXZPQQFFGJQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9N3/c1-3-7-4-8-6(2)11-12-9(8)10-5-7/h3-5H,1H2,2H3,(H,10,11,12).
What are the key properties of 5-ethenyl-3-methyl-2H-pyrazolo[3,4-b]pyridine?
5-ethenyl-3-methyl-2H-pyrazolo[3,4-b]pyridine has a molecular weight of 159.19 g/mol, XLogP of 1.91, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethenyl-3-methyl-2H-pyrazolo[3,4-b]pyridine is sourced from PubChem (CID 148629869), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).