1-(6-bromo-2-methylimidazo[1,2-a]pyridin-8-yl)-2,2,2-trifluoroethanol

C10H8BrF3N2O — CID 156533059

IUPAC1-(6-bromo-2-methylimidazo[1,2-a]pyridin-8-yl)-2,2,2-trifluoroethanol
SMILESCc1cn2cc(Br)cc(C(O)C(F)(F)F)c2n1
InChIInChI=1S/C10H8BrF3N2O/c1-5-3-16-4-6(11)2-7(9(16)15-5)8(17)10(12,13)14/h2-4,8,17H,1H3
InChIKeyPAZVRICNGHGIKD-UHFFFAOYSA-N
MW309.09 g/mol
LogP3.00
Rot. Bonds1

About 1-(6-bromo-2-methylimidazo[1,2-a]pyridin-8-yl)-2,2,2-trifluoroethanol

1-(6-bromo-2-methylimidazo[1,2-a]pyridin-8-yl)-2,2,2-trifluoroethanol (PubChem CID 156533059) has the molecular formula C10H8BrF3N2O and a molecular weight of 309.09 g/mol. Its IUPAC name is 1-(6-bromo-2-methylimidazo[1,2-a]pyridin-8-yl)-2,2,2-trifluoroethanol.

Molecular Properties

Compound Name1-(6-bromo-2-methylimidazo[1,2-a]pyridin-8-yl)-2,2,2-trifluoroethanol
PubChem CID156533059
Molecular FormulaC10H8BrF3N2O
Molecular Weight309.09 g/mol
Exact Mass307.98
IUPAC Name1-(6-bromo-2-methylimidazo[1,2-a]pyridin-8-yl)-2,2,2-trifluoroethanol
SMILESCc1cn2cc(Br)cc(C(O)C(F)(F)F)c2n1
InChIInChI=1S/C10H8BrF3N2O/c1-5-3-16-4-6(11)2-7(9(16)15-5)8(17)10(12,13)14/h2-4,8,17H,1H3
InChIKeyPAZVRICNGHGIKD-UHFFFAOYSA-N
XLogP3.00
TPSA37.53 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.09
LogP ≤ 53.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(6-bromo-2-methylimidazo[1,2-a]pyridin-8-yl)-2,2,2-trifluoroethanol?
The IUPAC name of 1-(6-bromo-2-methylimidazo[1,2-a]pyridin-8-yl)-2,2,2-trifluoroethanol (CID 156533059) is 1-(6-bromo-2-methylimidazo[1,2-a]pyridin-8-yl)-2,2,2-trifluoroethanol.
What is the SMILES notation for 1-(6-bromo-2-methylimidazo[1,2-a]pyridin-8-yl)-2,2,2-trifluoroethanol?
The canonical SMILES for 1-(6-bromo-2-methylimidazo[1,2-a]pyridin-8-yl)-2,2,2-trifluoroethanol is Cc1cn2cc(Br)cc(C(O)C(F)(F)F)c2n1.
What is the InChIKey of 1-(6-bromo-2-methylimidazo[1,2-a]pyridin-8-yl)-2,2,2-trifluoroethanol?
The InChIKey is PAZVRICNGHGIKD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8BrF3N2O/c1-5-3-16-4-6(11)2-7(9(16)15-5)8(17)10(12,13)14/h2-4,8,17H,1H3.
What are the key properties of 1-(6-bromo-2-methylimidazo[1,2-a]pyridin-8-yl)-2,2,2-trifluoroethanol?
1-(6-bromo-2-methylimidazo[1,2-a]pyridin-8-yl)-2,2,2-trifluoroethanol has a molecular weight of 309.09 g/mol, XLogP of 3.00, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6-bromo-2-methylimidazo[1,2-a]pyridin-8-yl)-2,2,2-trifluoroethanol is sourced from PubChem (CID 156533059), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).