4-(difluoromethyl)-2-fluoro-3-iodo-6-(trifluoromethoxy)pyridine

C7H2F6INO — CID 118812829

IUPAC4-(difluoromethyl)-2-fluoro-3-iodo-6-(trifluoromethoxy)pyridine
SMILESFc1nc(OC(F)(F)F)cc(C(F)F)c1I
InChIInChI=1S/C7H2F6INO/c8-5(9)2-1-3(16-7(11,12)13)15-6(10)4(2)14/h1,5H
InChIKeySDVRQULBRSSLHI-UHFFFAOYSA-N
MW356.99 g/mol
LogP3.66
Rot. Bonds2

About 4-(difluoromethyl)-2-fluoro-3-iodo-6-(trifluoromethoxy)pyridine

4-(difluoromethyl)-2-fluoro-3-iodo-6-(trifluoromethoxy)pyridine (PubChem CID 118812829) has the molecular formula C7H2F6INO and a molecular weight of 356.99 g/mol. Its IUPAC name is 4-(difluoromethyl)-2-fluoro-3-iodo-6-(trifluoromethoxy)pyridine.

Molecular Properties

Compound Name4-(difluoromethyl)-2-fluoro-3-iodo-6-(trifluoromethoxy)pyridine
PubChem CID118812829
Molecular FormulaC7H2F6INO
Molecular Weight356.99 g/mol
Exact Mass356.91
IUPAC Name4-(difluoromethyl)-2-fluoro-3-iodo-6-(trifluoromethoxy)pyridine
SMILESFc1nc(OC(F)(F)F)cc(C(F)F)c1I
InChIInChI=1S/C7H2F6INO/c8-5(9)2-1-3(16-7(11,12)13)15-6(10)4(2)14/h1,5H
InChIKeySDVRQULBRSSLHI-UHFFFAOYSA-N
XLogP3.66
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.99
LogP ≤ 53.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'iodine', 'substructure': 'N/A'}

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Related Compounds

4-(difluoromethyl)-2-fluoro-6-(trifluoromethoxy)-3-(trifluoromethyl)pyridine
CID 118828825
4-(difluoromethyl)-3-fluoro-2-iodo-6-(trifluoromethoxy)pyridine
CID 118851432
2,4-difluoro-3-iodo-6-(trifluoromethoxy)pyridine
CID 130094224
4-(difluoromethyl)-2-iodo-6-(trifluoromethoxy)pyridin-3-ol
CID 118823942
4-(difluoromethyl)-3-fluoro-6-(trifluoromethoxy)-2-(trifluoromethyl)pyridine
CID 134665522
4-(difluoromethyl)-2-iodo-3-methoxy-6-(trifluoromethoxy)pyridine
CID 118823728
4-(difluoromethyl)-2-iodo-6-(trifluoromethoxy)pyridine-3-carbaldehyde
CID 118851687
3-(difluoromethyl)-2-fluoro-6-(trifluoromethoxy)pyridin-4-amine
CID 118823425
4-(difluoromethyl)-2-fluoro-6-methoxy-3-(trifluoromethoxy)pyridine
CID 118801347
6-(chloromethyl)-4-(difluoromethyl)-2-fluoro-3-iodopyridine
CID 130080047
3-(difluoromethyl)-6-iodo-5-(trifluoromethoxy)pyridin-2-amine
CID 119022211
3-(difluoromethyl)-2-iodo-6-(trifluoromethoxy)pyridin-4-amine
CID 118823436

Frequently Asked Questions

What is the IUPAC name of 4-(difluoromethyl)-2-fluoro-3-iodo-6-(trifluoromethoxy)pyridine?
The IUPAC name of 4-(difluoromethyl)-2-fluoro-3-iodo-6-(trifluoromethoxy)pyridine (CID 118812829) is 4-(difluoromethyl)-2-fluoro-3-iodo-6-(trifluoromethoxy)pyridine.
What is the SMILES notation for 4-(difluoromethyl)-2-fluoro-3-iodo-6-(trifluoromethoxy)pyridine?
The canonical SMILES for 4-(difluoromethyl)-2-fluoro-3-iodo-6-(trifluoromethoxy)pyridine is Fc1nc(OC(F)(F)F)cc(C(F)F)c1I.
What is the InChIKey of 4-(difluoromethyl)-2-fluoro-3-iodo-6-(trifluoromethoxy)pyridine?
The InChIKey is SDVRQULBRSSLHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H2F6INO/c8-5(9)2-1-3(16-7(11,12)13)15-6(10)4(2)14/h1,5H.
What are the key properties of 4-(difluoromethyl)-2-fluoro-3-iodo-6-(trifluoromethoxy)pyridine?
4-(difluoromethyl)-2-fluoro-3-iodo-6-(trifluoromethoxy)pyridine has a molecular weight of 356.99 g/mol, XLogP of 3.66, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(difluoromethyl)-2-fluoro-3-iodo-6-(trifluoromethoxy)pyridine is sourced from PubChem (CID 118812829), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).