5,6-dimethyl-1H-pyrazolo[3,4-b]pyrazine

C7H8N4 — CID 121399479

IUPAC5,6-dimethyl-1H-pyrazolo[3,4-b]pyrazine
SMILESCc1nc2cn[nH]c2nc1C
InChIInChI=1S/C7H8N4/c1-4-5(2)10-7-6(9-4)3-8-11-7/h3H,1-2H3,(H,8,10,11)
InChIKeyBHUJTGJQTRTOJT-UHFFFAOYSA-N
MW148.17 g/mol
LogP0.97
Rot. Bonds

About 5,6-dimethyl-1H-pyrazolo[3,4-b]pyrazine

5,6-dimethyl-1H-pyrazolo[3,4-b]pyrazine (PubChem CID 121399479) has the molecular formula C7H8N4 and a molecular weight of 148.17 g/mol. Its IUPAC name is 5,6-dimethyl-1H-pyrazolo[3,4-b]pyrazine.

Molecular Properties

Compound Name5,6-dimethyl-1H-pyrazolo[3,4-b]pyrazine
PubChem CID121399479
Molecular FormulaC7H8N4
Molecular Weight148.17 g/mol
Exact Mass148.07
IUPAC Name5,6-dimethyl-1H-pyrazolo[3,4-b]pyrazine
SMILESCc1nc2cn[nH]c2nc1C
InChIInChI=1S/C7H8N4/c1-4-5(2)10-7-6(9-4)3-8-11-7/h3H,1-2H3,(H,8,10,11)
InChIKeyBHUJTGJQTRTOJT-UHFFFAOYSA-N
XLogP0.97
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.17
LogP ≤ 50.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

Triazolopyrimidine
CID 64962
3,4-Dimethylpyrazolo[5,1-c][1,2,4]triazine
CID 271622
4,7-Diaza-1H-indazole
CID 12913751
1-methyl-1H-pyrazolo(3,4-b)pyrazine
CID 59421494
Pyrazolo[4,3-e][1,2,4]triazine
CID 53633572
1h-Pyrazolo[3,4-b]pyrazin-3-amine
CID 294464
7H-triazolo[5,1-f][1,2,4]triazine-4,6-diimine
CID 246909
4-Methylpyrazolo[5,1-c][1,2,4]triazine
CID 13011562
1,5,6-trimethyl-1H-pyrazolo[3,4-b]pyrazine
CID 301595
1H-1,2,3-Triazolo[4,5-d]pyrimidin-5-amine
CID 585734
3-Bromo-1H-pyrazolo(3,4-b)pyrazine
CID 12913749
3-Methyl-1H-pyrazolo[4,3-b]pyrazine
CID 57415857

Frequently Asked Questions

What is the IUPAC name of 5,6-dimethyl-1H-pyrazolo[3,4-b]pyrazine?
The IUPAC name of 5,6-dimethyl-1H-pyrazolo[3,4-b]pyrazine (CID 121399479) is 5,6-dimethyl-1H-pyrazolo[3,4-b]pyrazine.
What is the SMILES notation for 5,6-dimethyl-1H-pyrazolo[3,4-b]pyrazine?
The canonical SMILES for 5,6-dimethyl-1H-pyrazolo[3,4-b]pyrazine is Cc1nc2cn[nH]c2nc1C.
What is the InChIKey of 5,6-dimethyl-1H-pyrazolo[3,4-b]pyrazine?
The InChIKey is BHUJTGJQTRTOJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8N4/c1-4-5(2)10-7-6(9-4)3-8-11-7/h3H,1-2H3,(H,8,10,11).
What are the key properties of 5,6-dimethyl-1H-pyrazolo[3,4-b]pyrazine?
5,6-dimethyl-1H-pyrazolo[3,4-b]pyrazine has a molecular weight of 148.17 g/mol, XLogP of 0.97, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5,6-dimethyl-1H-pyrazolo[3,4-b]pyrazine is sourced from PubChem (CID 121399479), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).