4,6-dimethyl-2-(2,2,2-trifluoroethyl)furo[2,3-b]pyridine

C11H10F3NO — CID 134605046

IUPAC4,6-dimethyl-2-(2,2,2-trifluoroethyl)furo[2,3-b]pyridine
SMILESCc1cc(C)c2cc(CC(F)(F)F)oc2n1
InChIInChI=1S/C11H10F3NO/c1-6-3-7(2)15-10-9(6)4-8(16-10)5-11(12,13)14/h3-4H,5H2,1-2H3
InChIKeyKTTMXGAHMORODD-UHFFFAOYSA-N
MW229.20 g/mol
LogP3.55
Rot. Bonds1

About 4,6-dimethyl-2-(2,2,2-trifluoroethyl)furo[2,3-b]pyridine

4,6-dimethyl-2-(2,2,2-trifluoroethyl)furo[2,3-b]pyridine (PubChem CID 134605046) has the molecular formula C11H10F3NO and a molecular weight of 229.20 g/mol. Its IUPAC name is 4,6-dimethyl-2-(2,2,2-trifluoroethyl)furo[2,3-b]pyridine.

Molecular Properties

Compound Name4,6-dimethyl-2-(2,2,2-trifluoroethyl)furo[2,3-b]pyridine
PubChem CID134605046
Molecular FormulaC11H10F3NO
Molecular Weight229.20 g/mol
Exact Mass229.07
IUPAC Name4,6-dimethyl-2-(2,2,2-trifluoroethyl)furo[2,3-b]pyridine
SMILESCc1cc(C)c2cc(CC(F)(F)F)oc2n1
InChIInChI=1S/C11H10F3NO/c1-6-3-7(2)15-10-9(6)4-8(16-10)5-11(12,13)14/h3-4H,5H2,1-2H3
InChIKeyKTTMXGAHMORODD-UHFFFAOYSA-N
XLogP3.55
TPSA26.03 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.20
LogP ≤ 53.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4,6-dimethyl-2-(2,2,2-trifluoroethyl)furo[2,3-b]pyridine?
The IUPAC name of 4,6-dimethyl-2-(2,2,2-trifluoroethyl)furo[2,3-b]pyridine (CID 134605046) is 4,6-dimethyl-2-(2,2,2-trifluoroethyl)furo[2,3-b]pyridine.
What is the SMILES notation for 4,6-dimethyl-2-(2,2,2-trifluoroethyl)furo[2,3-b]pyridine?
The canonical SMILES for 4,6-dimethyl-2-(2,2,2-trifluoroethyl)furo[2,3-b]pyridine is Cc1cc(C)c2cc(CC(F)(F)F)oc2n1.
What is the InChIKey of 4,6-dimethyl-2-(2,2,2-trifluoroethyl)furo[2,3-b]pyridine?
The InChIKey is KTTMXGAHMORODD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10F3NO/c1-6-3-7(2)15-10-9(6)4-8(16-10)5-11(12,13)14/h3-4H,5H2,1-2H3.
What are the key properties of 4,6-dimethyl-2-(2,2,2-trifluoroethyl)furo[2,3-b]pyridine?
4,6-dimethyl-2-(2,2,2-trifluoroethyl)furo[2,3-b]pyridine has a molecular weight of 229.20 g/mol, XLogP of 3.55, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4,6-dimethyl-2-(2,2,2-trifluoroethyl)furo[2,3-b]pyridine is sourced from PubChem (CID 134605046), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).