5,7-dimethyl-2-methylsulfanylpyrazolo[1,5-a]pyridine-3-carbonitrile

C11H11N3S — CID 134909522

IUPAC5,7-dimethyl-2-methylsulfanylpyrazolo[1,5-a]pyridine-3-carbonitrile
SMILESCSc1nn2c(C)cc(C)cc2c1C#N
InChIInChI=1S/C11H11N3S/c1-7-4-8(2)14-10(5-7)9(6-12)11(13-14)15-3/h4-5H,1-3H3
InChIKeyCGRLMNVFQXODFU-UHFFFAOYSA-N
MW217.30 g/mol
LogP2.54
Rot. Bonds1

About 5,7-dimethyl-2-methylsulfanylpyrazolo[1,5-a]pyridine-3-carbonitrile

5,7-dimethyl-2-methylsulfanylpyrazolo[1,5-a]pyridine-3-carbonitrile (PubChem CID 134909522) has the molecular formula C11H11N3S and a molecular weight of 217.30 g/mol. Its IUPAC name is 5,7-dimethyl-2-methylsulfanylpyrazolo[1,5-a]pyridine-3-carbonitrile.

Molecular Properties

Compound Name5,7-dimethyl-2-methylsulfanylpyrazolo[1,5-a]pyridine-3-carbonitrile
PubChem CID134909522
Molecular FormulaC11H11N3S
Molecular Weight217.30 g/mol
Exact Mass217.07
IUPAC Name5,7-dimethyl-2-methylsulfanylpyrazolo[1,5-a]pyridine-3-carbonitrile
SMILESCSc1nn2c(C)cc(C)cc2c1C#N
InChIInChI=1S/C11H11N3S/c1-7-4-8(2)14-10(5-7)9(6-12)11(13-14)15-3/h4-5H,1-3H3
InChIKeyCGRLMNVFQXODFU-UHFFFAOYSA-N
XLogP2.54
TPSA41.09 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.30
LogP ≤ 52.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

Ethane;2-methyl-7-propan-2-yl-3-(trifluoromethylsulfanyl)pyrazolo[1,5-a]pyridine
CID 178124797
2,7-Di(propan-2-yl)-3-(trifluoromethylsulfanyl)pyrazolo[1,5-a]pyridine
CID 178124886
2,3,7-Trimethylpyrazolo[1,5-a]pyridine
CID 594455
Pyrazolo[1,5-a]pyridine-3-carbonitrile, 2-(methylthio)-
CID 13440829
5,7-Dimethyl-2-phenylpyrazolo[1,5-a]pyridine-4-carbonitrile
CID 13775701
2,5,7-Trimethylpyrazolo[1,5-a]pyridine-4-carbonitrile
CID 134909385
Ethyl 2-(3-cyano-5,7-dimethylpyrazolo[1,5-a]pyridin-2-yl)sulfanylacetate
CID 134909520
2-Ethylsulfanyl-5,7-dimethylpyrazolo[1,5-a]pyridine-3-carbonitrile
CID 134989854
2-Ethylsulfanylpyrazolo[1,5-a]pyridine-3-carbonitrile
CID 134990046
2-Methyl-7-propan-2-yl-3-(trifluoromethylsulfanyl)pyrazolo[1,5-a]pyridine
CID 178124798
2-Methyl-9-methylsulfanyl-5,6,7,8-tetrahydropyrazolo[1,5-b]isoquinoline
CID 10998888
3-Methylsulfanyl-1,5-diphenylpyrazole-4-carbonitrile
CID 12455566

Frequently Asked Questions

What is the IUPAC name of 5,7-dimethyl-2-methylsulfanylpyrazolo[1,5-a]pyridine-3-carbonitrile?
The IUPAC name of 5,7-dimethyl-2-methylsulfanylpyrazolo[1,5-a]pyridine-3-carbonitrile (CID 134909522) is 5,7-dimethyl-2-methylsulfanylpyrazolo[1,5-a]pyridine-3-carbonitrile.
What is the SMILES notation for 5,7-dimethyl-2-methylsulfanylpyrazolo[1,5-a]pyridine-3-carbonitrile?
The canonical SMILES for 5,7-dimethyl-2-methylsulfanylpyrazolo[1,5-a]pyridine-3-carbonitrile is CSc1nn2c(C)cc(C)cc2c1C#N.
What is the InChIKey of 5,7-dimethyl-2-methylsulfanylpyrazolo[1,5-a]pyridine-3-carbonitrile?
The InChIKey is CGRLMNVFQXODFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11N3S/c1-7-4-8(2)14-10(5-7)9(6-12)11(13-14)15-3/h4-5H,1-3H3.
What are the key properties of 5,7-dimethyl-2-methylsulfanylpyrazolo[1,5-a]pyridine-3-carbonitrile?
5,7-dimethyl-2-methylsulfanylpyrazolo[1,5-a]pyridine-3-carbonitrile has a molecular weight of 217.30 g/mol, XLogP of 2.54, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5,7-dimethyl-2-methylsulfanylpyrazolo[1,5-a]pyridine-3-carbonitrile is sourced from PubChem (CID 134909522), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).