6-methylsulfanylpyrazolo[1,5-a]pyrazine

C7H7N3S — CID 170375120

IUPAC6-methylsulfanylpyrazolo[1,5-a]pyrazine
SMILESCSc1cn2nccc2cn1
InChIInChI=1S/C7H7N3S/c1-11-7-5-10-6(4-8-7)2-3-9-10/h2-5H,1H3
InChIKeyFOSFJPRCZKKOQK-UHFFFAOYSA-N
MW165.22 g/mol
LogP1.45
Rot. Bonds1

About 6-methylsulfanylpyrazolo[1,5-a]pyrazine

6-methylsulfanylpyrazolo[1,5-a]pyrazine (PubChem CID 170375120) has the molecular formula C7H7N3S and a molecular weight of 165.22 g/mol. Its IUPAC name is 6-methylsulfanylpyrazolo[1,5-a]pyrazine.

Molecular Properties

Compound Name6-methylsulfanylpyrazolo[1,5-a]pyrazine
PubChem CID170375120
Molecular FormulaC7H7N3S
Molecular Weight165.22 g/mol
Exact Mass165.04
IUPAC Name6-methylsulfanylpyrazolo[1,5-a]pyrazine
SMILESCSc1cn2nccc2cn1
InChIInChI=1S/C7H7N3S/c1-11-7-5-10-6(4-8-7)2-3-9-10/h2-5H,1H3
InChIKeyFOSFJPRCZKKOQK-UHFFFAOYSA-N
XLogP1.45
TPSA30.19 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.22
LogP ≤ 51.45
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

Thiazolo[4,5-D]pyridazine
CID 18758265
Thiazolopyridazine
CID 18758278
Pyrazolo[1,5-a]pyrazine
CID 21873758
7-Fluoropyrazolo[1,5-a]pyrazine
CID 176894498
7-(Trifluoromethyl)pyrazolo[1,5-a]pyrazine
CID 176894499
Ethane;6-(trifluoromethyl)pyrazolo[1,5-a]pyrazine
CID 177972712
Pyrazolo-1,3-thiazine
CID 163183768
4-Fluoropyrazolo[1,5-a]pyrazine
CID 171036106
6-(Trifluoromethyl)pyrazolo[1,5-a]pyrazine
CID 177972713
6-Methyl-[1,3]thiazolo[5,4-c]pyridazine
CID 21139044
3-Methylpyrazolo[1,5-a]pyrazine
CID 58303259
6-Bromopyrazolo[1,5-a]pyrazine
CID 87570899

Frequently Asked Questions

What is the IUPAC name of 6-methylsulfanylpyrazolo[1,5-a]pyrazine?
The IUPAC name of 6-methylsulfanylpyrazolo[1,5-a]pyrazine (CID 170375120) is 6-methylsulfanylpyrazolo[1,5-a]pyrazine.
What is the SMILES notation for 6-methylsulfanylpyrazolo[1,5-a]pyrazine?
The canonical SMILES for 6-methylsulfanylpyrazolo[1,5-a]pyrazine is CSc1cn2nccc2cn1.
What is the InChIKey of 6-methylsulfanylpyrazolo[1,5-a]pyrazine?
The InChIKey is FOSFJPRCZKKOQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7N3S/c1-11-7-5-10-6(4-8-7)2-3-9-10/h2-5H,1H3.
What are the key properties of 6-methylsulfanylpyrazolo[1,5-a]pyrazine?
6-methylsulfanylpyrazolo[1,5-a]pyrazine has a molecular weight of 165.22 g/mol, XLogP of 1.45, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methylsulfanylpyrazolo[1,5-a]pyrazine is sourced from PubChem (CID 170375120), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).