2-(trifluoromethyl)-6,8-dihydro-5H-pyrano[3,4-b]pyridine

C9H8F3NO — CID 164866939

IUPAC2-(trifluoromethyl)-6,8-dihydro-5H-pyrano[3,4-b]pyridine
SMILESFC(F)(F)c1ccc2c(n1)COCC2
InChIInChI=1S/C9H8F3NO/c10-9(11,12)8-2-1-6-3-4-14-5-7(6)13-8/h1-2H,3-5H2
InChIKeyLQJJEPLRHGBGTI-UHFFFAOYSA-N
MW203.16 g/mol
LogP2.17
Rot. Bonds

About 2-(trifluoromethyl)-6,8-dihydro-5H-pyrano[3,4-b]pyridine

2-(trifluoromethyl)-6,8-dihydro-5H-pyrano[3,4-b]pyridine (PubChem CID 164866939) has the molecular formula C9H8F3NO and a molecular weight of 203.16 g/mol. Its IUPAC name is 2-(trifluoromethyl)-6,8-dihydro-5H-pyrano[3,4-b]pyridine.

Molecular Properties

Compound Name2-(trifluoromethyl)-6,8-dihydro-5H-pyrano[3,4-b]pyridine
PubChem CID164866939
Molecular FormulaC9H8F3NO
Molecular Weight203.16 g/mol
Exact Mass203.06
IUPAC Name2-(trifluoromethyl)-6,8-dihydro-5H-pyrano[3,4-b]pyridine
SMILESFC(F)(F)c1ccc2c(n1)COCC2
InChIInChI=1S/C9H8F3NO/c10-9(11,12)8-2-1-6-3-4-14-5-7(6)13-8/h1-2H,3-5H2
InChIKeyLQJJEPLRHGBGTI-UHFFFAOYSA-N
XLogP2.17
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.16
LogP ≤ 52.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(trifluoromethyl)-6,8-dihydro-5H-pyrano[3,4-b]pyridine?
The IUPAC name of 2-(trifluoromethyl)-6,8-dihydro-5H-pyrano[3,4-b]pyridine (CID 164866939) is 2-(trifluoromethyl)-6,8-dihydro-5H-pyrano[3,4-b]pyridine.
What is the SMILES notation for 2-(trifluoromethyl)-6,8-dihydro-5H-pyrano[3,4-b]pyridine?
The canonical SMILES for 2-(trifluoromethyl)-6,8-dihydro-5H-pyrano[3,4-b]pyridine is FC(F)(F)c1ccc2c(n1)COCC2.
What is the InChIKey of 2-(trifluoromethyl)-6,8-dihydro-5H-pyrano[3,4-b]pyridine?
The InChIKey is LQJJEPLRHGBGTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8F3NO/c10-9(11,12)8-2-1-6-3-4-14-5-7(6)13-8/h1-2H,3-5H2.
What are the key properties of 2-(trifluoromethyl)-6,8-dihydro-5H-pyrano[3,4-b]pyridine?
2-(trifluoromethyl)-6,8-dihydro-5H-pyrano[3,4-b]pyridine has a molecular weight of 203.16 g/mol, XLogP of 2.17, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(trifluoromethyl)-6,8-dihydro-5H-pyrano[3,4-b]pyridine is sourced from PubChem (CID 164866939), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).