6-[4-(trifluoromethoxy)phenyl]-3-(trifluoromethyl)imidazo[1,2-a]pyridine

C15H8F6N2O — CID 127044897

IUPAC6-[4-(trifluoromethoxy)phenyl]-3-(trifluoromethyl)imidazo[1,2-a]pyridine
SMILESFC(F)(F)Oc1ccc(-c2ccc3ncc(C(F)(F)F)n3c2)cc1
InChIInChI=1S/C15H8F6N2O/c16-14(17,18)12-7-22-13-6-3-10(8-23(12)13)9-1-4-11(5-2-9)24-15(19,20)21/h1-8H
InChIKeyWIBWEQRTGVQDDM-UHFFFAOYSA-N
MW346.23 g/mol
LogP4.92
Rot. Bonds2

About 6-[4-(trifluoromethoxy)phenyl]-3-(trifluoromethyl)imidazo[1,2-a]pyridine

6-[4-(trifluoromethoxy)phenyl]-3-(trifluoromethyl)imidazo[1,2-a]pyridine (PubChem CID 127044897) has the molecular formula C15H8F6N2O and a molecular weight of 346.23 g/mol. Its IUPAC name is 6-[4-(trifluoromethoxy)phenyl]-3-(trifluoromethyl)imidazo[1,2-a]pyridine.

Molecular Properties

Compound Name6-[4-(trifluoromethoxy)phenyl]-3-(trifluoromethyl)imidazo[1,2-a]pyridine
PubChem CID127044897
Molecular FormulaC15H8F6N2O
Molecular Weight346.23 g/mol
Exact Mass346.05
IUPAC Name6-[4-(trifluoromethoxy)phenyl]-3-(trifluoromethyl)imidazo[1,2-a]pyridine
SMILESFC(F)(F)Oc1ccc(-c2ccc3ncc(C(F)(F)F)n3c2)cc1
InChIInChI=1S/C15H8F6N2O/c16-14(17,18)12-7-22-13-6-3-10(8-23(12)13)9-1-4-11(5-2-9)24-15(19,20)21/h1-8H
InChIKeyWIBWEQRTGVQDDM-UHFFFAOYSA-N
XLogP4.92
TPSA26.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.23
LogP ≤ 54.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-[4-(trifluoromethoxy)phenyl]-3-(trifluoromethyl)imidazo[1,2-a]pyridine?
The IUPAC name of 6-[4-(trifluoromethoxy)phenyl]-3-(trifluoromethyl)imidazo[1,2-a]pyridine (CID 127044897) is 6-[4-(trifluoromethoxy)phenyl]-3-(trifluoromethyl)imidazo[1,2-a]pyridine.
What is the SMILES notation for 6-[4-(trifluoromethoxy)phenyl]-3-(trifluoromethyl)imidazo[1,2-a]pyridine?
The canonical SMILES for 6-[4-(trifluoromethoxy)phenyl]-3-(trifluoromethyl)imidazo[1,2-a]pyridine is FC(F)(F)Oc1ccc(-c2ccc3ncc(C(F)(F)F)n3c2)cc1.
What is the InChIKey of 6-[4-(trifluoromethoxy)phenyl]-3-(trifluoromethyl)imidazo[1,2-a]pyridine?
The InChIKey is WIBWEQRTGVQDDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H8F6N2O/c16-14(17,18)12-7-22-13-6-3-10(8-23(12)13)9-1-4-11(5-2-9)24-15(19,20)21/h1-8H.
What are the key properties of 6-[4-(trifluoromethoxy)phenyl]-3-(trifluoromethyl)imidazo[1,2-a]pyridine?
6-[4-(trifluoromethoxy)phenyl]-3-(trifluoromethyl)imidazo[1,2-a]pyridine has a molecular weight of 346.23 g/mol, XLogP of 4.92, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[4-(trifluoromethoxy)phenyl]-3-(trifluoromethyl)imidazo[1,2-a]pyridine is sourced from PubChem (CID 127044897), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).