ethane;3-methyl-6-(2-methylsulfanylpropan-2-yl)pyrazolo[1,5-a]pyridine

C14H22N2S — CID 155727663

IUPACethane;3-methyl-6-(2-methylsulfanylpropan-2-yl)pyrazolo[1,5-a]pyridine
SMILESCC.CSC(C)(C)c1ccc2c(C)cnn2c1
InChIInChI=1S/C12H16N2S.C2H6/c1-9-7-13-14-8-10(5-6-11(9)14)12(2,3)15-4;1-2/h5-8H,1-4H3;1-2H3
InChIKeyKWPNCWFQAQALEX-UHFFFAOYSA-N
MW250.41 g/mol
LogP4.27
Rot. Bonds2

About ethane;3-methyl-6-(2-methylsulfanylpropan-2-yl)pyrazolo[1,5-a]pyridine

ethane;3-methyl-6-(2-methylsulfanylpropan-2-yl)pyrazolo[1,5-a]pyridine (PubChem CID 155727663) has the molecular formula C14H22N2S and a molecular weight of 250.41 g/mol. Its IUPAC name is ethane;3-methyl-6-(2-methylsulfanylpropan-2-yl)pyrazolo[1,5-a]pyridine.

Molecular Properties

Compound Nameethane;3-methyl-6-(2-methylsulfanylpropan-2-yl)pyrazolo[1,5-a]pyridine
PubChem CID155727663
Molecular FormulaC14H22N2S
Molecular Weight250.41 g/mol
Exact Mass250.15
IUPAC Nameethane;3-methyl-6-(2-methylsulfanylpropan-2-yl)pyrazolo[1,5-a]pyridine
SMILESCC.CSC(C)(C)c1ccc2c(C)cnn2c1
InChIInChI=1S/C12H16N2S.C2H6/c1-9-7-13-14-8-10(5-6-11(9)14)12(2,3)15-4;1-2/h5-8H,1-4H3;1-2H3
InChIKeyKWPNCWFQAQALEX-UHFFFAOYSA-N
XLogP4.27
TPSA17.30 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.41
LogP ≤ 54.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

3,6-dimethylpyrazolo[1,5-a]pyridine;ethane
CID 164882940
N-ethyl-2-methyl-2-(3-methylpyrazolo[1,5-a]pyridin-6-yl)propanamide
CID 174364006
N,N-dimethyl-2-[2-methyl-2-(3-methylpyrazolo[1,5-a]pyridin-6-yl)propoxy]acetamide;ethane
CID 155727269
3-ethylsulfonyl-6-(trifluoromethyl)pyrazolo[1,5-a]pyridine
CID 175835574
methyl 3-methylpyrazolo[1,5-a]pyridine-6-carboxylate
CID 166128420
4-(3-methylpyrazolo[1,5-a]pyridin-6-yl)morpholine
CID 170144843
6-(2-hydroxypropan-2-yl)pyrazolo[1,5-a]pyridine-3-carboxylic acid
CID 169163238
ethane;1-(3-methylpyrazolo[1,5-a]pyridin-6-yl)cyclobutane-1-carbonitrile
CID 155727464
6-(3-fluoro-2-pyridinyl)-3-methylpyrazolo[1,5-a]pyridine
CID 170379706
ethane;2-methyl-2-(3-methylpyrazolo[1,5-a]pyrimidin-6-yl)propanenitrile
CID 155727279
3-methylimino-2-(3-methylpyrazolo[1,5-a]pyridin-6-yl)prop-1-en-1-amine
CID 174021301
5-chloro-6-fluoro-3-methylpyrazolo[1,5-a]pyridine
CID 169167608

Frequently Asked Questions

What is the IUPAC name of ethane;3-methyl-6-(2-methylsulfanylpropan-2-yl)pyrazolo[1,5-a]pyridine?
The IUPAC name of ethane;3-methyl-6-(2-methylsulfanylpropan-2-yl)pyrazolo[1,5-a]pyridine (CID 155727663) is ethane;3-methyl-6-(2-methylsulfanylpropan-2-yl)pyrazolo[1,5-a]pyridine.
What is the SMILES notation for ethane;3-methyl-6-(2-methylsulfanylpropan-2-yl)pyrazolo[1,5-a]pyridine?
The canonical SMILES for ethane;3-methyl-6-(2-methylsulfanylpropan-2-yl)pyrazolo[1,5-a]pyridine is CC.CSC(C)(C)c1ccc2c(C)cnn2c1.
What is the InChIKey of ethane;3-methyl-6-(2-methylsulfanylpropan-2-yl)pyrazolo[1,5-a]pyridine?
The InChIKey is KWPNCWFQAQALEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N2S.C2H6/c1-9-7-13-14-8-10(5-6-11(9)14)12(2,3)15-4;1-2/h5-8H,1-4H3;1-2H3.
What are the key properties of ethane;3-methyl-6-(2-methylsulfanylpropan-2-yl)pyrazolo[1,5-a]pyridine?
ethane;3-methyl-6-(2-methylsulfanylpropan-2-yl)pyrazolo[1,5-a]pyridine has a molecular weight of 250.41 g/mol, XLogP of 4.27, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;3-methyl-6-(2-methylsulfanylpropan-2-yl)pyrazolo[1,5-a]pyridine is sourced from PubChem (CID 155727663), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).