1-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]ethenol

C10H7F3N2O — CID 138663722

IUPAC1-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]ethenol
SMILESC=C(O)c1cn2cc(C(F)(F)F)ccc2n1
InChIInChI=1S/C10H7F3N2O/c1-6(16)8-5-15-4-7(10(11,12)13)2-3-9(15)14-8/h2-5,16H,1H2
InChIKeyKHLMYEKYKFVMAR-UHFFFAOYSA-N
MW228.17 g/mol
LogP2.88
Rot. Bonds1

About 1-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]ethenol

1-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]ethenol (PubChem CID 138663722) has the molecular formula C10H7F3N2O and a molecular weight of 228.17 g/mol. Its IUPAC name is 1-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]ethenol.

Molecular Properties

Compound Name1-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]ethenol
PubChem CID138663722
Molecular FormulaC10H7F3N2O
Molecular Weight228.17 g/mol
Exact Mass228.05
IUPAC Name1-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]ethenol
SMILESC=C(O)c1cn2cc(C(F)(F)F)ccc2n1
InChIInChI=1S/C10H7F3N2O/c1-6(16)8-5-15-4-7(10(11,12)13)2-3-9(15)14-8/h2-5,16H,1H2
InChIKeyKHLMYEKYKFVMAR-UHFFFAOYSA-N
XLogP2.88
TPSA37.53 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.17
LogP ≤ 52.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]ethenol?
The IUPAC name of 1-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]ethenol (CID 138663722) is 1-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]ethenol.
What is the SMILES notation for 1-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]ethenol?
The canonical SMILES for 1-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]ethenol is C=C(O)c1cn2cc(C(F)(F)F)ccc2n1.
What is the InChIKey of 1-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]ethenol?
The InChIKey is KHLMYEKYKFVMAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7F3N2O/c1-6(16)8-5-15-4-7(10(11,12)13)2-3-9(15)14-8/h2-5,16H,1H2.
What are the key properties of 1-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]ethenol?
1-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]ethenol has a molecular weight of 228.17 g/mol, XLogP of 2.88, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[6-(trifluoromethyl)imidazo[1,2-a]pyridin-2-yl]ethenol is sourced from PubChem (CID 138663722), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).