5-(fluoromethyl)-3,4-dihydro-2H-pyran

C6H9FO — CID 115011074

IUPAC5-(fluoromethyl)-3,4-dihydro-2H-pyran
SMILESFCC1=COCCC1
InChIInChI=1S/C6H9FO/c7-4-6-2-1-3-8-5-6/h5H,1-4H2
InChIKeyKKRAIKKOCIUKPJ-UHFFFAOYSA-N
MW116.13 g/mol
LogP1.65
Rot. Bonds1

About 5-(fluoromethyl)-3,4-dihydro-2H-pyran

5-(fluoromethyl)-3,4-dihydro-2H-pyran (PubChem CID 115011074) has the molecular formula C6H9FO and a molecular weight of 116.13 g/mol. Its IUPAC name is 5-(fluoromethyl)-3,4-dihydro-2H-pyran.

Molecular Properties

Compound Name5-(fluoromethyl)-3,4-dihydro-2H-pyran
PubChem CID115011074
Molecular FormulaC6H9FO
Molecular Weight116.13 g/mol
Exact Mass116.06
IUPAC Name5-(fluoromethyl)-3,4-dihydro-2H-pyran
SMILESFCC1=COCCC1
InChIInChI=1S/C6H9FO/c7-4-6-2-1-3-8-5-6/h5H,1-4H2
InChIKeyKKRAIKKOCIUKPJ-UHFFFAOYSA-N
XLogP1.65
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500116.13
LogP ≤ 51.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

5-Methyl-3,4-dihydro-2H-pyran
CID 12724530
5-(trifluoromethyl)-3,4-dihydro-2H-pyran
CID 153944429
2-Fluoro-2,5-dimethyl-3,4-dihydropyran
CID 174971168
InChI=1/C7H12O/c1-2-7-4-3-5-8-6-7/h6H,2-5H2,1H
CID 5325608
5-(difluoromethyl)-3,4-dihydro-2H-pyran
CID 115011275
5-ethenyl-3,4-dihydro-2H-pyran
CID 11159306
5-methyl-3,4-dihydro-2H-pyran-2-ide;tris(yttrium)
CID 59875984
ethane;5-methyl-3,4-dihydro-2H-pyran
CID 144201777
5-methyl-3,4-dihydro-2H-pyran;yttrium
CID 157416458
5-methyl-3,4-dihydro-2H-pyran;propane
CID 163247082
ethane;5-methyl-3,4-dihydro-2H-pyran
CID 167500418

Frequently Asked Questions

What is the IUPAC name of 5-(fluoromethyl)-3,4-dihydro-2H-pyran?
The IUPAC name of 5-(fluoromethyl)-3,4-dihydro-2H-pyran (CID 115011074) is 5-(fluoromethyl)-3,4-dihydro-2H-pyran.
What is the SMILES notation for 5-(fluoromethyl)-3,4-dihydro-2H-pyran?
The canonical SMILES for 5-(fluoromethyl)-3,4-dihydro-2H-pyran is FCC1=COCCC1.
What is the InChIKey of 5-(fluoromethyl)-3,4-dihydro-2H-pyran?
The InChIKey is KKRAIKKOCIUKPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9FO/c7-4-6-2-1-3-8-5-6/h5H,1-4H2.
What are the key properties of 5-(fluoromethyl)-3,4-dihydro-2H-pyran?
5-(fluoromethyl)-3,4-dihydro-2H-pyran has a molecular weight of 116.13 g/mol, XLogP of 1.65, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(fluoromethyl)-3,4-dihydro-2H-pyran is sourced from PubChem (CID 115011074), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).