5-methylsulfanyl-6-[3-methyl-6-(trifluoromethyl)imidazo[4,5-c]pyridin-2-yl]pyridin-3-ol

C14H11F3N4OS — CID 145096413

IUPAC5-methylsulfanyl-6-[3-methyl-6-(trifluoromethyl)imidazo[4,5-c]pyridin-2-yl]pyridin-3-ol
SMILESCSc1cc(O)cnc1-c1nc2cc(C(F)(F)F)ncc2n1C
InChIInChI=1S/C14H11F3N4OS/c1-21-9-6-18-11(14(15,16)17)4-8(9)20-13(21)12-10(23-2)3-7(22)5-19-12/h3-6,22H,1-2H3
InChIKeyRBIYVDLLHQKYHT-UHFFFAOYSA-N
MW340.33 g/mol
LogP3.48
Rot. Bonds2

About 5-methylsulfanyl-6-[3-methyl-6-(trifluoromethyl)imidazo[4,5-c]pyridin-2-yl]pyridin-3-ol

5-methylsulfanyl-6-[3-methyl-6-(trifluoromethyl)imidazo[4,5-c]pyridin-2-yl]pyridin-3-ol (PubChem CID 145096413) has the molecular formula C14H11F3N4OS and a molecular weight of 340.33 g/mol. Its IUPAC name is 5-methylsulfanyl-6-[3-methyl-6-(trifluoromethyl)imidazo[4,5-c]pyridin-2-yl]pyridin-3-ol.

Molecular Properties

Compound Name5-methylsulfanyl-6-[3-methyl-6-(trifluoromethyl)imidazo[4,5-c]pyridin-2-yl]pyridin-3-ol
PubChem CID145096413
Molecular FormulaC14H11F3N4OS
Molecular Weight340.33 g/mol
Exact Mass340.06
IUPAC Name5-methylsulfanyl-6-[3-methyl-6-(trifluoromethyl)imidazo[4,5-c]pyridin-2-yl]pyridin-3-ol
SMILESCSc1cc(O)cnc1-c1nc2cc(C(F)(F)F)ncc2n1C
InChIInChI=1S/C14H11F3N4OS/c1-21-9-6-18-11(14(15,16)17)4-8(9)20-13(21)12-10(23-2)3-7(22)5-19-12/h3-6,22H,1-2H3
InChIKeyRBIYVDLLHQKYHT-UHFFFAOYSA-N
XLogP3.48
TPSA63.83 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.33
LogP ≤ 53.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 5-methylsulfanyl-6-[3-methyl-6-(trifluoromethyl)imidazo[4,5-c]pyridin-2-yl]pyridin-3-ol with MolForge

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Related Compounds

2-[5-(Difluoromethoxy)-3-ethylsulfanyl-2-pyridyl]-3-methyl-6-(trifluoromethyl)imidazo[4,5-c]pyridine
CID 117781020
2-[5-(Difluoromethoxy)-3-ethylsulfonyl-2-pyridyl]-3-methyl-6-(trifluoromethyl)imidazo[4,5-c]pyridine
CID 117814335
2-[5-(Difluoromethoxy)-3-ethylsulfinyl-2-pyridinyl]-3-methyl-6-(trifluoromethyl)imidazo[4,5-c]pyridine
CID 123197728
2-[3-Ethylsulfanyl-5-(2-methylprop-2-enoxy)pyridin-2-yl]-3-methyl-6-(trifluoromethyl)imidazo[4,5-c]pyridine
CID 132200225
2-[5-Ethylsulfanyl-6-[3-methyl-6-(trifluoromethyl)imidazo[4,5-c]pyridin-2-yl]pyridin-3-yl]oxyacetonitrile
CID 135368070
2-[5-(1,3-Difluoropropan-2-yloxy)-3-ethylsulfonylpyridin-2-yl]-3-methyl-6-(trifluoromethyl)imidazo[4,5-c]pyridine
CID 135368089
2-[5-Ethylsulfanyl-6-[3-methyl-6-(trifluoromethyl)imidazo[4,5-c]pyridin-2-yl]pyridin-3-yl]oxy-2-methylpropanenitrile
CID 135368091
2-[3-Ethylsulfonyl-5-(2-methylsulfanylethoxy)pyridin-2-yl]-3-methyl-6-(trifluoromethyl)imidazo[4,5-c]pyridine
CID 135368093
3-[5-Ethylsulfonyl-6-[3-methyl-6-(trifluoromethyl)imidazo[4,5-c]pyridin-2-yl]pyridin-3-yl]oxycyclobutan-1-ol
CID 135368111
2-[3-Ethylsulfonyl-5-[(2-methylpropan-2-yl)oxy]pyridin-2-yl]-3-methyl-6-(trifluoromethyl)imidazo[4,5-c]pyridine
CID 135368132
2-[3-Ethylsulfanyl-5-[(2-methylpropan-2-yl)oxy]pyridin-2-yl]-3-methyl-6-(trifluoromethyl)imidazo[4,5-c]pyridine
CID 135368168
2-[3-Ethylsulfanyl-5-(3-methyloxetan-3-yl)oxypyridin-2-yl]-3-methyl-6-(trifluoromethyl)imidazo[4,5-c]pyridine
CID 135368449

Frequently Asked Questions

What is the IUPAC name of 5-methylsulfanyl-6-[3-methyl-6-(trifluoromethyl)imidazo[4,5-c]pyridin-2-yl]pyridin-3-ol?
The IUPAC name of 5-methylsulfanyl-6-[3-methyl-6-(trifluoromethyl)imidazo[4,5-c]pyridin-2-yl]pyridin-3-ol (CID 145096413) is 5-methylsulfanyl-6-[3-methyl-6-(trifluoromethyl)imidazo[4,5-c]pyridin-2-yl]pyridin-3-ol.
What is the SMILES notation for 5-methylsulfanyl-6-[3-methyl-6-(trifluoromethyl)imidazo[4,5-c]pyridin-2-yl]pyridin-3-ol?
The canonical SMILES for 5-methylsulfanyl-6-[3-methyl-6-(trifluoromethyl)imidazo[4,5-c]pyridin-2-yl]pyridin-3-ol is CSc1cc(O)cnc1-c1nc2cc(C(F)(F)F)ncc2n1C.
What is the InChIKey of 5-methylsulfanyl-6-[3-methyl-6-(trifluoromethyl)imidazo[4,5-c]pyridin-2-yl]pyridin-3-ol?
The InChIKey is RBIYVDLLHQKYHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11F3N4OS/c1-21-9-6-18-11(14(15,16)17)4-8(9)20-13(21)12-10(23-2)3-7(22)5-19-12/h3-6,22H,1-2H3.
What are the key properties of 5-methylsulfanyl-6-[3-methyl-6-(trifluoromethyl)imidazo[4,5-c]pyridin-2-yl]pyridin-3-ol?
5-methylsulfanyl-6-[3-methyl-6-(trifluoromethyl)imidazo[4,5-c]pyridin-2-yl]pyridin-3-ol has a molecular weight of 340.33 g/mol, XLogP of 3.48, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methylsulfanyl-6-[3-methyl-6-(trifluoromethyl)imidazo[4,5-c]pyridin-2-yl]pyridin-3-ol is sourced from PubChem (CID 145096413), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).