[6-(difluoromethyl)-3-fluoro-5-iodo-2-pyridinyl]methanol

C7H5F3INO — CID 118854432

IUPAC[6-(difluoromethyl)-3-fluoro-5-iodo-2-pyridinyl]methanol
SMILESOCc1nc(C(F)F)c(I)cc1F
InChIInChI=1S/C7H5F3INO/c8-3-1-4(11)6(7(9)10)12-5(3)2-13/h1,7,13H,2H2
InChIKeyZWMOZTMXKMMGNT-UHFFFAOYSA-N
MW303.02 g/mol
LogP2.26
Rot. Bonds2

About [6-(difluoromethyl)-3-fluoro-5-iodo-2-pyridinyl]methanol

[6-(difluoromethyl)-3-fluoro-5-iodo-2-pyridinyl]methanol (PubChem CID 118854432) has the molecular formula C7H5F3INO and a molecular weight of 303.02 g/mol. Its IUPAC name is [6-(difluoromethyl)-3-fluoro-5-iodo-2-pyridinyl]methanol.

Molecular Properties

Compound Name[6-(difluoromethyl)-3-fluoro-5-iodo-2-pyridinyl]methanol
PubChem CID118854432
Molecular FormulaC7H5F3INO
Molecular Weight303.02 g/mol
Exact Mass302.94
IUPAC Name[6-(difluoromethyl)-3-fluoro-5-iodo-2-pyridinyl]methanol
SMILESOCc1nc(C(F)F)c(I)cc1F
InChIInChI=1S/C7H5F3INO/c8-3-1-4(11)6(7(9)10)12-5(3)2-13/h1,7,13H,2H2
InChIKeyZWMOZTMXKMMGNT-UHFFFAOYSA-N
XLogP2.26
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.02
LogP ≤ 52.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

[6-(difluoromethyl)-5-iodo-3-(trifluoromethoxy)-2-pyridinyl]methanol
CID 118826147
[2-amino-6-(difluoromethyl)-5-iodo-3-pyridinyl]methanol
CID 118993177
[2-chloro-6-(difluoromethyl)-5-iodo-3-pyridinyl]methanol
CID 118990772
[3-(difluoromethyl)-5-fluoro-6-iodo-2-pyridinyl]methanol
CID 130080196
methyl 6-(difluoromethyl)-3-fluoro-5-iodopyridine-2-carboxylate
CID 130080291
[6-(aminomethyl)-2-(difluoromethyl)-5-iodo-3-pyridinyl]methanol
CID 118820073
2-(difluoromethyl)-3-fluoro-5,6-diiodopyridine
CID 130100474
2-(bromomethyl)-6-(difluoromethyl)-5-iodopyridine-3-carboxylic acid
CID 130087218
2-[6-(difluoromethyl)-5-iodo-3-methyl-2-pyridinyl]acetic acid
CID 130086318
methyl 2-[3-chloro-6-(difluoromethyl)-5-iodo-2-pyridinyl]acetate
CID 134673837
methyl 2-[3-amino-6-(difluoromethyl)-5-iodo-2-pyridinyl]acetate
CID 134683210
2-(chloromethyl)-6-(difluoromethyl)-5-iodo-3-(trifluoromethyl)pyridine
CID 118815578

Frequently Asked Questions

What is the IUPAC name of [6-(difluoromethyl)-3-fluoro-5-iodo-2-pyridinyl]methanol?
The IUPAC name of [6-(difluoromethyl)-3-fluoro-5-iodo-2-pyridinyl]methanol (CID 118854432) is [6-(difluoromethyl)-3-fluoro-5-iodo-2-pyridinyl]methanol.
What is the SMILES notation for [6-(difluoromethyl)-3-fluoro-5-iodo-2-pyridinyl]methanol?
The canonical SMILES for [6-(difluoromethyl)-3-fluoro-5-iodo-2-pyridinyl]methanol is OCc1nc(C(F)F)c(I)cc1F.
What is the InChIKey of [6-(difluoromethyl)-3-fluoro-5-iodo-2-pyridinyl]methanol?
The InChIKey is ZWMOZTMXKMMGNT-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H5F3INO/c8-3-1-4(11)6(7(9)10)12-5(3)2-13/h1,7,13H,2H2.
What are the key properties of [6-(difluoromethyl)-3-fluoro-5-iodo-2-pyridinyl]methanol?
[6-(difluoromethyl)-3-fluoro-5-iodo-2-pyridinyl]methanol has a molecular weight of 303.02 g/mol, XLogP of 2.26, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(difluoromethyl)-3-fluoro-5-iodo-2-pyridinyl]methanol is sourced from PubChem (CID 118854432), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).