4-methoxy-2-[5-(trifluoromethyl)thiophen-3-yl]oxypyridine

C11H8F3NO2S — CID 57086015

IUPAC4-methoxy-2-[5-(trifluoromethyl)thiophen-3-yl]oxypyridine
SMILESCOc1ccnc(Oc2csc(C(F)(F)F)c2)c1
InChIInChI=1S/C11H8F3NO2S/c1-16-7-2-3-15-10(5-7)17-8-4-9(18-6-8)11(12,13)14/h2-6H,1H3
InChIKeyBMFAFNGRWSMPHG-UHFFFAOYSA-N
MW275.25 g/mol
LogP3.96
Rot. Bonds3

About 4-methoxy-2-[5-(trifluoromethyl)thiophen-3-yl]oxypyridine

4-methoxy-2-[5-(trifluoromethyl)thiophen-3-yl]oxypyridine (PubChem CID 57086015) has the molecular formula C11H8F3NO2S and a molecular weight of 275.25 g/mol. Its IUPAC name is 4-methoxy-2-[5-(trifluoromethyl)thiophen-3-yl]oxypyridine.

Molecular Properties

Compound Name4-methoxy-2-[5-(trifluoromethyl)thiophen-3-yl]oxypyridine
PubChem CID57086015
Molecular FormulaC11H8F3NO2S
Molecular Weight275.25 g/mol
Exact Mass275.02
IUPAC Name4-methoxy-2-[5-(trifluoromethyl)thiophen-3-yl]oxypyridine
SMILESCOc1ccnc(Oc2csc(C(F)(F)F)c2)c1
InChIInChI=1S/C11H8F3NO2S/c1-16-7-2-3-15-10(5-7)17-8-4-9(18-6-8)11(12,13)14/h2-6H,1H3
InChIKeyBMFAFNGRWSMPHG-UHFFFAOYSA-N
XLogP3.96
TPSA31.35 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.25
LogP ≤ 53.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-methoxy-2-[5-(trifluoromethyl)thiophen-3-yl]oxypyridine?
The IUPAC name of 4-methoxy-2-[5-(trifluoromethyl)thiophen-3-yl]oxypyridine (CID 57086015) is 4-methoxy-2-[5-(trifluoromethyl)thiophen-3-yl]oxypyridine.
What is the SMILES notation for 4-methoxy-2-[5-(trifluoromethyl)thiophen-3-yl]oxypyridine?
The canonical SMILES for 4-methoxy-2-[5-(trifluoromethyl)thiophen-3-yl]oxypyridine is COc1ccnc(Oc2csc(C(F)(F)F)c2)c1.
What is the InChIKey of 4-methoxy-2-[5-(trifluoromethyl)thiophen-3-yl]oxypyridine?
The InChIKey is BMFAFNGRWSMPHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8F3NO2S/c1-16-7-2-3-15-10(5-7)17-8-4-9(18-6-8)11(12,13)14/h2-6H,1H3.
What are the key properties of 4-methoxy-2-[5-(trifluoromethyl)thiophen-3-yl]oxypyridine?
4-methoxy-2-[5-(trifluoromethyl)thiophen-3-yl]oxypyridine has a molecular weight of 275.25 g/mol, XLogP of 3.96, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-2-[5-(trifluoromethyl)thiophen-3-yl]oxypyridine is sourced from PubChem (CID 57086015), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).