6-(difluoromethyl)-5-iodo-1H-pyridin-2-one

C6H4F2INO — CID 118825976

IUPAC6-(difluoromethyl)-5-iodo-1H-pyridin-2-one
SMILESO=c1ccc(I)c(C(F)F)[nH]1
InChIInChI=1S/C6H4F2INO/c7-6(8)5-3(9)1-2-4(11)10-5/h1-2,6H,(H,10,11)
InChIKeyTWFYYAVVPHJUKV-UHFFFAOYSA-N
MW271.00 g/mol
LogP1.92
Rot. Bonds1

About 6-(difluoromethyl)-5-iodo-1H-pyridin-2-one

6-(difluoromethyl)-5-iodo-1H-pyridin-2-one (PubChem CID 118825976) has the molecular formula C6H4F2INO and a molecular weight of 271.00 g/mol. Its IUPAC name is 6-(difluoromethyl)-5-iodo-1H-pyridin-2-one.

Molecular Properties

Compound Name6-(difluoromethyl)-5-iodo-1H-pyridin-2-one
PubChem CID118825976
Molecular FormulaC6H4F2INO
Molecular Weight271.00 g/mol
Exact Mass270.93
IUPAC Name6-(difluoromethyl)-5-iodo-1H-pyridin-2-one
SMILESO=c1ccc(I)c(C(F)F)[nH]1
InChIInChI=1S/C6H4F2INO/c7-6(8)5-3(9)1-2-4(11)10-5/h1-2,6H,(H,10,11)
InChIKeyTWFYYAVVPHJUKV-UHFFFAOYSA-N
XLogP1.92
TPSA32.86 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.00
LogP ≤ 51.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'iodine', 'substructure': 'N/A'}

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Related Compounds

6-(difluoromethyl)-5-fluoro-1H-pyridin-2-one
CID 130096189
6-(difluoromethyl)-5-fluoro-4-iodo-1H-pyridin-2-one
CID 118826088
2-(difluoromethyl)-6-oxo-1H-pyridine-3-carbonyl chloride
CID 118837824
5-(bromomethyl)-6-(difluoromethyl)-4-iodo-1H-pyridin-2-one
CID 130082637
4-(aminomethyl)-6-(difluoromethyl)-5-iodo-1H-pyridin-2-one
CID 130082600
6-(difluoromethyl)-5-fluoro-3-iodo-1H-pyridin-2-one
CID 118837355
6-(difluoromethyl)-3-(hydroxymethyl)-5-iodo-1H-pyridin-2-one
CID 130082788
6-(difluoromethyl)-5-iodo-2-oxo-1H-pyridine-3-carbonitrile
CID 130076426
6-(difluoromethyl)-4-(hydroxymethyl)-5-iodo-1H-pyridin-2-one
CID 118803664
6-(difluoromethyl)-3-iodo-5-methyl-1H-pyridin-2-one
CID 118837451
4,5-dichloro-6-(difluoromethyl)-1H-pyridin-2-one
CID 130099225
2-(difluoromethyl)-5-iodo-6-oxo-1H-pyridine-3-carbaldehyde
CID 118832066

Frequently Asked Questions

What is the IUPAC name of 6-(difluoromethyl)-5-iodo-1H-pyridin-2-one?
The IUPAC name of 6-(difluoromethyl)-5-iodo-1H-pyridin-2-one (CID 118825976) is 6-(difluoromethyl)-5-iodo-1H-pyridin-2-one.
What is the SMILES notation for 6-(difluoromethyl)-5-iodo-1H-pyridin-2-one?
The canonical SMILES for 6-(difluoromethyl)-5-iodo-1H-pyridin-2-one is O=c1ccc(I)c(C(F)F)[nH]1.
What is the InChIKey of 6-(difluoromethyl)-5-iodo-1H-pyridin-2-one?
The InChIKey is TWFYYAVVPHJUKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H4F2INO/c7-6(8)5-3(9)1-2-4(11)10-5/h1-2,6H,(H,10,11).
What are the key properties of 6-(difluoromethyl)-5-iodo-1H-pyridin-2-one?
6-(difluoromethyl)-5-iodo-1H-pyridin-2-one has a molecular weight of 271.00 g/mol, XLogP of 1.92, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(difluoromethyl)-5-iodo-1H-pyridin-2-one is sourced from PubChem (CID 118825976), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).