3-methyl-2H-pyrazolo[3,4-b]pyrazine

C6H6N4 — CID 57415857

IUPAC3-methyl-2H-pyrazolo[3,4-b]pyrazine
SMILESCc1[nH]nc2nccnc12
InChIInChI=1S/C6H6N4/c1-4-5-6(10-9-4)8-3-2-7-5/h2-3H,1H3,(H,8,9,10)
InChIKeyQIXKPYPWMQXIGY-UHFFFAOYSA-N
MW134.14 g/mol
LogP0.66
Rot. Bonds

About 3-methyl-2H-pyrazolo[3,4-b]pyrazine

3-methyl-2H-pyrazolo[3,4-b]pyrazine (PubChem CID 57415857) has the molecular formula C6H6N4 and a molecular weight of 134.14 g/mol. Its IUPAC name is 3-methyl-2H-pyrazolo[3,4-b]pyrazine.

Molecular Properties

Compound Name3-methyl-2H-pyrazolo[3,4-b]pyrazine
PubChem CID57415857
Molecular FormulaC6H6N4
Molecular Weight134.14 g/mol
Exact Mass134.06
IUPAC Name3-methyl-2H-pyrazolo[3,4-b]pyrazine
SMILESCc1[nH]nc2nccnc12
InChIInChI=1S/C6H6N4/c1-4-5-6(10-9-4)8-3-2-7-5/h2-3H,1H3,(H,8,9,10)
InChIKeyQIXKPYPWMQXIGY-UHFFFAOYSA-N
XLogP0.66
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500134.14
LogP ≤ 50.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4,7-Diaza-1H-indazole
CID 12913751
1-methyl-1H-pyrazolo(3,4-b)pyrazine
CID 59421494
5,8-dimethyl-2-[(E)-2-[2-methyl-5-(1H-pyrazol-5-yl)-1,2,4-triazol-3-yl]ethenyl]-[1,2,4]triazolo[1,5-a]pyrazine
CID 165415127
1H-Pyrazolo(4,3-d)pyrimidin-7-amine
CID 96600
1h-Pyrazolo[3,4-b]pyrazin-3-amine
CID 294464
3-Bromo-1H-pyrazolo(3,4-b)pyrazine
CID 12913749
6-chloro-3-methyl-1H-pyrazolo(3,4-d)pyrimidine
CID 17569283
2-Methylpyrazolo(1,5-a)pyrimidin-6-amine
CID 25247809
3-Amino-5-bromo-1H-pyrazolo(3,4-b)pyrazine
CID 57415872
5-Chloro-1H-pyrazolo(4,3-d)pyrimidine
CID 59796947
6-Chloro-1H-pyrazolo[3,4-b]pyrazine
CID 71463967
2-Methylpyrazolo(1,5-a)pyrimidin-3-amine hydrochloride
CID 146154023

Frequently Asked Questions

What is the IUPAC name of 3-methyl-2H-pyrazolo[3,4-b]pyrazine?
The IUPAC name of 3-methyl-2H-pyrazolo[3,4-b]pyrazine (CID 57415857) is 3-methyl-2H-pyrazolo[3,4-b]pyrazine.
What is the SMILES notation for 3-methyl-2H-pyrazolo[3,4-b]pyrazine?
The canonical SMILES for 3-methyl-2H-pyrazolo[3,4-b]pyrazine is Cc1[nH]nc2nccnc12.
What is the InChIKey of 3-methyl-2H-pyrazolo[3,4-b]pyrazine?
The InChIKey is QIXKPYPWMQXIGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H6N4/c1-4-5-6(10-9-4)8-3-2-7-5/h2-3H,1H3,(H,8,9,10).
What are the key properties of 3-methyl-2H-pyrazolo[3,4-b]pyrazine?
3-methyl-2H-pyrazolo[3,4-b]pyrazine has a molecular weight of 134.14 g/mol, XLogP of 0.66, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-2H-pyrazolo[3,4-b]pyrazine is sourced from PubChem (CID 57415857), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).