[2-tert-butyl-6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]methanol

C13H15F3N2O — CID 82060770

IUPAC[2-tert-butyl-6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]methanol
SMILESCC(C)(C)c1nc2ccc(C(F)(F)F)cn2c1CO
InChIInChI=1S/C13H15F3N2O/c1-12(2,3)11-9(7-19)18-6-8(13(14,15)16)4-5-10(18)17-11/h4-6,19H,7H2,1-3H3
InChIKeyUPTBAGRSMPDBOK-UHFFFAOYSA-N
MW272.27 g/mol
LogP3.14
Rot. Bonds1

About [2-tert-butyl-6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]methanol

[2-tert-butyl-6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]methanol (PubChem CID 82060770) has the molecular formula C13H15F3N2O and a molecular weight of 272.27 g/mol. Its IUPAC name is [2-tert-butyl-6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]methanol.

Molecular Properties

Compound Name[2-tert-butyl-6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]methanol
PubChem CID82060770
Molecular FormulaC13H15F3N2O
Molecular Weight272.27 g/mol
Exact Mass272.11
IUPAC Name[2-tert-butyl-6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]methanol
SMILESCC(C)(C)c1nc2ccc(C(F)(F)F)cn2c1CO
InChIInChI=1S/C13H15F3N2O/c1-12(2,3)11-9(7-19)18-6-8(13(14,15)16)4-5-10(18)17-11/h4-6,19H,7H2,1-3H3
InChIKeyUPTBAGRSMPDBOK-UHFFFAOYSA-N
XLogP3.14
TPSA37.53 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.27
LogP ≤ 53.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [2-tert-butyl-6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]methanol?
The IUPAC name of [2-tert-butyl-6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]methanol (CID 82060770) is [2-tert-butyl-6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]methanol.
What is the SMILES notation for [2-tert-butyl-6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]methanol?
The canonical SMILES for [2-tert-butyl-6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]methanol is CC(C)(C)c1nc2ccc(C(F)(F)F)cn2c1CO.
What is the InChIKey of [2-tert-butyl-6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]methanol?
The InChIKey is UPTBAGRSMPDBOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15F3N2O/c1-12(2,3)11-9(7-19)18-6-8(13(14,15)16)4-5-10(18)17-11/h4-6,19H,7H2,1-3H3.
What are the key properties of [2-tert-butyl-6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]methanol?
[2-tert-butyl-6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]methanol has a molecular weight of 272.27 g/mol, XLogP of 3.14, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-tert-butyl-6-(trifluoromethyl)imidazo[1,2-a]pyridin-3-yl]methanol is sourced from PubChem (CID 82060770), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).