4-[2-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]phenol

C14H9F3N2O — CID 138384051

IUPAC4-[2-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]phenol
SMILESOc1ccc(-c2c(C(F)(F)F)nc3ccccn23)cc1
InChIInChI=1S/C14H9F3N2O/c15-14(16,17)13-12(9-4-6-10(20)7-5-9)19-8-2-1-3-11(19)18-13/h1-8,20H
InChIKeyKIFFELOETCRTOP-UHFFFAOYSA-N
MW278.23 g/mol
LogP3.73
Rot. Bonds1

About 4-[2-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]phenol

4-[2-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]phenol (PubChem CID 138384051) has the molecular formula C14H9F3N2O and a molecular weight of 278.23 g/mol. Its IUPAC name is 4-[2-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]phenol.

Molecular Properties

Compound Name4-[2-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]phenol
PubChem CID138384051
Molecular FormulaC14H9F3N2O
Molecular Weight278.23 g/mol
Exact Mass278.07
IUPAC Name4-[2-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]phenol
SMILESOc1ccc(-c2c(C(F)(F)F)nc3ccccn23)cc1
InChIInChI=1S/C14H9F3N2O/c15-14(16,17)13-12(9-4-6-10(20)7-5-9)19-8-2-1-3-11(19)18-13/h1-8,20H
InChIKeyKIFFELOETCRTOP-UHFFFAOYSA-N
XLogP3.73
TPSA37.53 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.23
LogP ≤ 53.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-[2-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]phenol?
The IUPAC name of 4-[2-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]phenol (CID 138384051) is 4-[2-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]phenol.
What is the SMILES notation for 4-[2-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]phenol?
The canonical SMILES for 4-[2-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]phenol is Oc1ccc(-c2c(C(F)(F)F)nc3ccccn23)cc1.
What is the InChIKey of 4-[2-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]phenol?
The InChIKey is KIFFELOETCRTOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H9F3N2O/c15-14(16,17)13-12(9-4-6-10(20)7-5-9)19-8-2-1-3-11(19)18-13/h1-8,20H.
What are the key properties of 4-[2-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]phenol?
4-[2-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]phenol has a molecular weight of 278.23 g/mol, XLogP of 3.73, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]phenol is sourced from PubChem (CID 138384051), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).