fluoromethane;6-(trifluoromethyl)-1H-pyridin-2-one

C7H7F4NO — CID 143740800

IUPACfluoromethane;6-(trifluoromethyl)-1H-pyridin-2-one
SMILESCF.O=c1cccc(C(F)(F)F)[nH]1
InChIInChI=1S/C6H4F3NO.CH3F/c7-6(8,9)4-2-1-3-5(11)10-4;1-2/h1-3H,(H,10,11);1H3
InChIKeyWHSAMUUTSXJSFW-UHFFFAOYSA-N
MW197.13 g/mol
LogP1.98
Rot. Bonds

About fluoromethane;6-(trifluoromethyl)-1H-pyridin-2-one

fluoromethane;6-(trifluoromethyl)-1H-pyridin-2-one (PubChem CID 143740800) has the molecular formula C7H7F4NO and a molecular weight of 197.13 g/mol. Its IUPAC name is fluoromethane;6-(trifluoromethyl)-1H-pyridin-2-one.

Molecular Properties

Compound Namefluoromethane;6-(trifluoromethyl)-1H-pyridin-2-one
PubChem CID143740800
Molecular FormulaC7H7F4NO
Molecular Weight197.13 g/mol
Exact Mass197.05
IUPAC Namefluoromethane;6-(trifluoromethyl)-1H-pyridin-2-one
SMILESCF.O=c1cccc(C(F)(F)F)[nH]1
InChIInChI=1S/C6H4F3NO.CH3F/c7-6(8,9)4-2-1-3-5(11)10-4;1-2/h1-3H,(H,10,11);1H3
InChIKeyWHSAMUUTSXJSFW-UHFFFAOYSA-N
XLogP1.98
TPSA32.86 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.13
LogP ≤ 51.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of fluoromethane;6-(trifluoromethyl)-1H-pyridin-2-one?
The IUPAC name of fluoromethane;6-(trifluoromethyl)-1H-pyridin-2-one (CID 143740800) is fluoromethane;6-(trifluoromethyl)-1H-pyridin-2-one.
What is the SMILES notation for fluoromethane;6-(trifluoromethyl)-1H-pyridin-2-one?
The canonical SMILES for fluoromethane;6-(trifluoromethyl)-1H-pyridin-2-one is CF.O=c1cccc(C(F)(F)F)[nH]1.
What is the InChIKey of fluoromethane;6-(trifluoromethyl)-1H-pyridin-2-one?
The InChIKey is WHSAMUUTSXJSFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H4F3NO.CH3F/c7-6(8,9)4-2-1-3-5(11)10-4;1-2/h1-3H,(H,10,11);1H3.
What are the key properties of fluoromethane;6-(trifluoromethyl)-1H-pyridin-2-one?
fluoromethane;6-(trifluoromethyl)-1H-pyridin-2-one has a molecular weight of 197.13 g/mol, XLogP of 1.98, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for fluoromethane;6-(trifluoromethyl)-1H-pyridin-2-one is sourced from PubChem (CID 143740800), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).