5-(difluoromethoxy)-1H-pyridin-2-one

C6H5F2NO2 — CID 14665037

IUPAC5-(difluoromethoxy)-1H-pyridin-2-one
SMILESO=c1ccc(OC(F)F)c[nH]1
InChIInChI=1S/C6H5F2NO2/c7-6(8)11-4-1-2-5(10)9-3-4/h1-3,6H,(H,9,10)
InChIKeyVRWFXRMPZMWPKH-UHFFFAOYSA-N
MW161.11 g/mol
LogP0.98
Rot. Bonds2

About 5-(difluoromethoxy)-1H-pyridin-2-one

5-(difluoromethoxy)-1H-pyridin-2-one (PubChem CID 14665037) has the molecular formula C6H5F2NO2 and a molecular weight of 161.11 g/mol. Its IUPAC name is 5-(difluoromethoxy)-1H-pyridin-2-one.

Molecular Properties

Compound Name5-(difluoromethoxy)-1H-pyridin-2-one
PubChem CID14665037
Molecular FormulaC6H5F2NO2
Molecular Weight161.11 g/mol
Exact Mass161.03
IUPAC Name5-(difluoromethoxy)-1H-pyridin-2-one
SMILESO=c1ccc(OC(F)F)c[nH]1
InChIInChI=1S/C6H5F2NO2/c7-6(8)11-4-1-2-5(10)9-3-4/h1-3,6H,(H,9,10)
InChIKeyVRWFXRMPZMWPKH-UHFFFAOYSA-N
XLogP0.98
TPSA42.09 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.11
LogP ≤ 50.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-(difluoromethoxy)-1H-pyridin-2-one?
The IUPAC name of 5-(difluoromethoxy)-1H-pyridin-2-one (CID 14665037) is 5-(difluoromethoxy)-1H-pyridin-2-one.
What is the SMILES notation for 5-(difluoromethoxy)-1H-pyridin-2-one?
The canonical SMILES for 5-(difluoromethoxy)-1H-pyridin-2-one is O=c1ccc(OC(F)F)c[nH]1.
What is the InChIKey of 5-(difluoromethoxy)-1H-pyridin-2-one?
The InChIKey is VRWFXRMPZMWPKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H5F2NO2/c7-6(8)11-4-1-2-5(10)9-3-4/h1-3,6H,(H,9,10).
What are the key properties of 5-(difluoromethoxy)-1H-pyridin-2-one?
5-(difluoromethoxy)-1H-pyridin-2-one has a molecular weight of 161.11 g/mol, XLogP of 0.98, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(difluoromethoxy)-1H-pyridin-2-one is sourced from PubChem (CID 14665037), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).