6,8-difluoro-3-(2,2,2-trifluoroethyl)imidazo[1,2-a]pyridine

C9H5F5N2 — CID 175130711

IUPAC6,8-difluoro-3-(2,2,2-trifluoroethyl)imidazo[1,2-a]pyridine
SMILESFc1cc(F)c2ncc(CC(F)(F)F)n2c1
InChIInChI=1S/C9H5F5N2/c10-5-1-7(11)8-15-3-6(16(8)4-5)2-9(12,13)14/h1,3-4H,2H2
InChIKeyVVQWSNGIYYRLNP-UHFFFAOYSA-N
MW236.14 g/mol
LogP2.72
Rot. Bonds1

About 6,8-difluoro-3-(2,2,2-trifluoroethyl)imidazo[1,2-a]pyridine

6,8-difluoro-3-(2,2,2-trifluoroethyl)imidazo[1,2-a]pyridine (PubChem CID 175130711) has the molecular formula C9H5F5N2 and a molecular weight of 236.14 g/mol. Its IUPAC name is 6,8-difluoro-3-(2,2,2-trifluoroethyl)imidazo[1,2-a]pyridine.

Molecular Properties

Compound Name6,8-difluoro-3-(2,2,2-trifluoroethyl)imidazo[1,2-a]pyridine
PubChem CID175130711
Molecular FormulaC9H5F5N2
Molecular Weight236.14 g/mol
Exact Mass236.04
IUPAC Name6,8-difluoro-3-(2,2,2-trifluoroethyl)imidazo[1,2-a]pyridine
SMILESFc1cc(F)c2ncc(CC(F)(F)F)n2c1
InChIInChI=1S/C9H5F5N2/c10-5-1-7(11)8-15-3-6(16(8)4-5)2-9(12,13)14/h1,3-4H,2H2
InChIKeyVVQWSNGIYYRLNP-UHFFFAOYSA-N
XLogP2.72
TPSA17.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.14
LogP ≤ 52.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6,8-difluoro-3-(2,2,2-trifluoroethyl)imidazo[1,2-a]pyridine?
The IUPAC name of 6,8-difluoro-3-(2,2,2-trifluoroethyl)imidazo[1,2-a]pyridine (CID 175130711) is 6,8-difluoro-3-(2,2,2-trifluoroethyl)imidazo[1,2-a]pyridine.
What is the SMILES notation for 6,8-difluoro-3-(2,2,2-trifluoroethyl)imidazo[1,2-a]pyridine?
The canonical SMILES for 6,8-difluoro-3-(2,2,2-trifluoroethyl)imidazo[1,2-a]pyridine is Fc1cc(F)c2ncc(CC(F)(F)F)n2c1.
What is the InChIKey of 6,8-difluoro-3-(2,2,2-trifluoroethyl)imidazo[1,2-a]pyridine?
The InChIKey is VVQWSNGIYYRLNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H5F5N2/c10-5-1-7(11)8-15-3-6(16(8)4-5)2-9(12,13)14/h1,3-4H,2H2.
What are the key properties of 6,8-difluoro-3-(2,2,2-trifluoroethyl)imidazo[1,2-a]pyridine?
6,8-difluoro-3-(2,2,2-trifluoroethyl)imidazo[1,2-a]pyridine has a molecular weight of 236.14 g/mol, XLogP of 2.72, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6,8-difluoro-3-(2,2,2-trifluoroethyl)imidazo[1,2-a]pyridine is sourced from PubChem (CID 175130711), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).