6-(trifluoromethyl)-3,4-dihydro-2H-pyran

C6H7F3O — CID 53441788

IUPAC6-(trifluoromethyl)-3,4-dihydro-2H-pyran
SMILESFC(F)(F)C1=CCCCO1
InChIInChI=1S/C6H7F3O/c7-6(8,9)5-3-1-2-4-10-5/h3H,1-2,4H2
InChIKeyHMXGFYKOTJREJI-UHFFFAOYSA-N
MW152.11 g/mol
LogP2.24
Rot. Bonds

About 6-(trifluoromethyl)-3,4-dihydro-2H-pyran

6-(trifluoromethyl)-3,4-dihydro-2H-pyran (PubChem CID 53441788) has the molecular formula C6H7F3O and a molecular weight of 152.11 g/mol. Its IUPAC name is 6-(trifluoromethyl)-3,4-dihydro-2H-pyran.

Molecular Properties

Compound Name6-(trifluoromethyl)-3,4-dihydro-2H-pyran
PubChem CID53441788
Molecular FormulaC6H7F3O
Molecular Weight152.11 g/mol
Exact Mass152.04
IUPAC Name6-(trifluoromethyl)-3,4-dihydro-2H-pyran
SMILESFC(F)(F)C1=CCCCO1
InChIInChI=1S/C6H7F3O/c7-6(8,9)5-3-1-2-4-10-5/h3H,1-2,4H2
InChIKeyHMXGFYKOTJREJI-UHFFFAOYSA-N
XLogP2.24
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.11
LogP ≤ 52.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 6-(trifluoromethyl)-3,4-dihydro-2H-pyran with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 6-(trifluoromethyl)-3,4-dihydro-2H-pyran?
The IUPAC name of 6-(trifluoromethyl)-3,4-dihydro-2H-pyran (CID 53441788) is 6-(trifluoromethyl)-3,4-dihydro-2H-pyran.
What is the SMILES notation for 6-(trifluoromethyl)-3,4-dihydro-2H-pyran?
The canonical SMILES for 6-(trifluoromethyl)-3,4-dihydro-2H-pyran is FC(F)(F)C1=CCCCO1.
What is the InChIKey of 6-(trifluoromethyl)-3,4-dihydro-2H-pyran?
The InChIKey is HMXGFYKOTJREJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H7F3O/c7-6(8,9)5-3-1-2-4-10-5/h3H,1-2,4H2.
What are the key properties of 6-(trifluoromethyl)-3,4-dihydro-2H-pyran?
6-(trifluoromethyl)-3,4-dihydro-2H-pyran has a molecular weight of 152.11 g/mol, XLogP of 2.24, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(trifluoromethyl)-3,4-dihydro-2H-pyran is sourced from PubChem (CID 53441788), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).