2-methoxy-5-(trifluoromethyl)-1H-imidazo[4,5-b]pyridine

C8H6F3N3O — CID 156690050

IUPAC2-methoxy-5-(trifluoromethyl)-1H-imidazo[4,5-b]pyridine
SMILESCOc1nc2nc(C(F)(F)F)ccc2[nH]1
InChIInChI=1S/C8H6F3N3O/c1-15-7-12-4-2-3-5(8(9,10)11)13-6(4)14-7/h2-3H,1H3,(H,12,13,14)
InChIKeyNPNZWZIROWOFKR-UHFFFAOYSA-N
MW217.15 g/mol
LogP1.99
Rot. Bonds1

About 2-methoxy-5-(trifluoromethyl)-1H-imidazo[4,5-b]pyridine

2-methoxy-5-(trifluoromethyl)-1H-imidazo[4,5-b]pyridine (PubChem CID 156690050) has the molecular formula C8H6F3N3O and a molecular weight of 217.15 g/mol. Its IUPAC name is 2-methoxy-5-(trifluoromethyl)-1H-imidazo[4,5-b]pyridine.

Molecular Properties

Compound Name2-methoxy-5-(trifluoromethyl)-1H-imidazo[4,5-b]pyridine
PubChem CID156690050
Molecular FormulaC8H6F3N3O
Molecular Weight217.15 g/mol
Exact Mass217.05
IUPAC Name2-methoxy-5-(trifluoromethyl)-1H-imidazo[4,5-b]pyridine
SMILESCOc1nc2nc(C(F)(F)F)ccc2[nH]1
InChIInChI=1S/C8H6F3N3O/c1-15-7-12-4-2-3-5(8(9,10)11)13-6(4)14-7/h2-3H,1H3,(H,12,13,14)
InChIKeyNPNZWZIROWOFKR-UHFFFAOYSA-N
XLogP1.99
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.15
LogP ≤ 51.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-ethyl-5-(trifluoromethyl)-1H-imidazo[4,5-b]pyridine
CID 156690056
2-fluoro-8-methoxy-7H-purine
CID 142660264
ethane;2-methoxy-3-methyl-6-(trifluoromethyl)pyridine
CID 156750344
2-methyl-4-methylidene-8-[5-(trifluoromethyl)-1H-imidazo[4,5-b]pyridin-2-yl]octan-2-ol
CID 139518403
CID 67411928
CID 67411928
5-[4-(6-fluoro-1H-benzimidazol-2-yl)piperazin-1-yl]-2-methoxy-1H-imidazo[4,5-b]pyridine
CID 141372570
8-methoxy-5-(6-methoxy-4-methyl-1H-benzimidazol-2-yl)-2-(trifluoromethyl)quinoline
CID 70343219
5-chloro-2-methoxy-4-methyl-1H-benzimidazole
CID 131002916
2-(2-fluoropropan-2-yl)-1H-imidazo[4,5-b]pyridin-5-amine
CID 127016339
5-ethoxy-2-(trifluoromethyl)-1H-imidazo[4,5-b]pyridine
CID 79815994
3-methoxy-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-6-(trifluoromethyl)pyridine
CID 172644510
3-methoxy-6-(trifluoromethyl)-2-[3-(trifluoromethyl)phenyl]pyridine
CID 134627212

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-5-(trifluoromethyl)-1H-imidazo[4,5-b]pyridine?
The IUPAC name of 2-methoxy-5-(trifluoromethyl)-1H-imidazo[4,5-b]pyridine (CID 156690050) is 2-methoxy-5-(trifluoromethyl)-1H-imidazo[4,5-b]pyridine.
What is the SMILES notation for 2-methoxy-5-(trifluoromethyl)-1H-imidazo[4,5-b]pyridine?
The canonical SMILES for 2-methoxy-5-(trifluoromethyl)-1H-imidazo[4,5-b]pyridine is COc1nc2nc(C(F)(F)F)ccc2[nH]1.
What is the InChIKey of 2-methoxy-5-(trifluoromethyl)-1H-imidazo[4,5-b]pyridine?
The InChIKey is NPNZWZIROWOFKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H6F3N3O/c1-15-7-12-4-2-3-5(8(9,10)11)13-6(4)14-7/h2-3H,1H3,(H,12,13,14).
What are the key properties of 2-methoxy-5-(trifluoromethyl)-1H-imidazo[4,5-b]pyridine?
2-methoxy-5-(trifluoromethyl)-1H-imidazo[4,5-b]pyridine has a molecular weight of 217.15 g/mol, XLogP of 1.99, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-5-(trifluoromethyl)-1H-imidazo[4,5-b]pyridine is sourced from PubChem (CID 156690050), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).