3-ethylsulfonyl-6-(trifluoromethyl)pyrazolo[1,5-a]pyridine

C10H9F3N2O2S — CID 175835574

IUPAC3-ethylsulfonyl-6-(trifluoromethyl)pyrazolo[1,5-a]pyridine
SMILESCCS(=O)(=O)c1cnn2cc(C(F)(F)F)ccc12
InChIInChI=1S/C10H9F3N2O2S/c1-2-18(16,17)9-5-14-15-6-7(10(11,12)13)3-4-8(9)15/h3-6H,2H2,1H3
InChIKeyNLYYGDPWEXJMPX-UHFFFAOYSA-N
MW278.26 g/mol
LogP2.15
Rot. Bonds2

About 3-ethylsulfonyl-6-(trifluoromethyl)pyrazolo[1,5-a]pyridine

3-ethylsulfonyl-6-(trifluoromethyl)pyrazolo[1,5-a]pyridine (PubChem CID 175835574) has the molecular formula C10H9F3N2O2S and a molecular weight of 278.26 g/mol. Its IUPAC name is 3-ethylsulfonyl-6-(trifluoromethyl)pyrazolo[1,5-a]pyridine.

Molecular Properties

Compound Name3-ethylsulfonyl-6-(trifluoromethyl)pyrazolo[1,5-a]pyridine
PubChem CID175835574
Molecular FormulaC10H9F3N2O2S
Molecular Weight278.26 g/mol
Exact Mass278.03
IUPAC Name3-ethylsulfonyl-6-(trifluoromethyl)pyrazolo[1,5-a]pyridine
SMILESCCS(=O)(=O)c1cnn2cc(C(F)(F)F)ccc12
InChIInChI=1S/C10H9F3N2O2S/c1-2-18(16,17)9-5-14-15-6-7(10(11,12)13)3-4-8(9)15/h3-6H,2H2,1H3
InChIKeyNLYYGDPWEXJMPX-UHFFFAOYSA-N
XLogP2.15
TPSA51.44 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.26
LogP ≤ 52.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2-ethylsulfonyl-1-fluoro-4-(trifluoromethyl)benzene
CID 157365281
4-bromo-1-[2-ethylsulfonyl-4-(trifluoromethyl)phenyl]-N-methylpyrazol-5-amine
CID 134448216
3-ethylsulfonyl-2-fluoro-6-(trifluoromethyl)imidazo[1,2-a]pyridine
CID 163663312
3-ethylsulfonyl-2-(4-iodopyrazol-1-yl)-5-(trifluoromethyl)pyridine
CID 121485081
2-(2-ethylsulfonylphenyl)-1-methyl-5-(trifluoromethyl)benzimidazole
CID 67984963
2-(5-ethylsulfonylpyrimidin-4-yl)-1-methyl-5-(trifluoromethyl)benzimidazole
CID 57345405
2-[2-ethylsulfonyl-4-(trifluoromethyl)phenyl]-6-(trifluoromethyl)indazole
CID 72704062
2-[2-ethylsulfonyl-4-(trifluoromethyl)phenyl]pyrimidin-5-ol
CID 129119909
[2-(3-iodopyrazolo[1,5-a]pyridin-6-yl)-2-methylpropyl] 4-methylbenzenesulfonate
CID 155349523
ethane;3-methyl-6-(2-methylsulfanylpropan-2-yl)pyrazolo[1,5-a]pyridine
CID 155727663
[2-[2-ethylsulfonyl-4-(trifluoromethyl)phenyl]pyrimidin-5-yl]methanol
CID 140939422
4-methyl-6-[6-(trifluoromethyl)pyrazolo[1,5-a]pyridin-3-yl]isoquinoline
CID 168925849

Frequently Asked Questions

What is the IUPAC name of 3-ethylsulfonyl-6-(trifluoromethyl)pyrazolo[1,5-a]pyridine?
The IUPAC name of 3-ethylsulfonyl-6-(trifluoromethyl)pyrazolo[1,5-a]pyridine (CID 175835574) is 3-ethylsulfonyl-6-(trifluoromethyl)pyrazolo[1,5-a]pyridine.
What is the SMILES notation for 3-ethylsulfonyl-6-(trifluoromethyl)pyrazolo[1,5-a]pyridine?
The canonical SMILES for 3-ethylsulfonyl-6-(trifluoromethyl)pyrazolo[1,5-a]pyridine is CCS(=O)(=O)c1cnn2cc(C(F)(F)F)ccc12.
What is the InChIKey of 3-ethylsulfonyl-6-(trifluoromethyl)pyrazolo[1,5-a]pyridine?
The InChIKey is NLYYGDPWEXJMPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9F3N2O2S/c1-2-18(16,17)9-5-14-15-6-7(10(11,12)13)3-4-8(9)15/h3-6H,2H2,1H3.
What are the key properties of 3-ethylsulfonyl-6-(trifluoromethyl)pyrazolo[1,5-a]pyridine?
3-ethylsulfonyl-6-(trifluoromethyl)pyrazolo[1,5-a]pyridine has a molecular weight of 278.26 g/mol, XLogP of 2.15, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethylsulfonyl-6-(trifluoromethyl)pyrazolo[1,5-a]pyridine is sourced from PubChem (CID 175835574), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).