5-(fluoromethyl)-4-iodo-2-(trifluoromethoxy)pyridin-3-ol

C7H4F4INO2 — CID 130111324

IUPAC5-(fluoromethyl)-4-iodo-2-(trifluoromethoxy)pyridin-3-ol
SMILESOc1c(OC(F)(F)F)ncc(CF)c1I
InChIInChI=1S/C7H4F4INO2/c8-1-3-2-13-6(5(14)4(3)12)15-7(9,10)11/h2,14H,1H2
InChIKeyUGURITGZOAFUSX-UHFFFAOYSA-N
MW337.01 g/mol
LogP2.76
Rot. Bonds2

About 5-(fluoromethyl)-4-iodo-2-(trifluoromethoxy)pyridin-3-ol

5-(fluoromethyl)-4-iodo-2-(trifluoromethoxy)pyridin-3-ol (PubChem CID 130111324) has the molecular formula C7H4F4INO2 and a molecular weight of 337.01 g/mol. Its IUPAC name is 5-(fluoromethyl)-4-iodo-2-(trifluoromethoxy)pyridin-3-ol.

Molecular Properties

Compound Name5-(fluoromethyl)-4-iodo-2-(trifluoromethoxy)pyridin-3-ol
PubChem CID130111324
Molecular FormulaC7H4F4INO2
Molecular Weight337.01 g/mol
Exact Mass336.92
IUPAC Name5-(fluoromethyl)-4-iodo-2-(trifluoromethoxy)pyridin-3-ol
SMILESOc1c(OC(F)(F)F)ncc(CF)c1I
InChIInChI=1S/C7H4F4INO2/c8-1-3-2-13-6(5(14)4(3)12)15-7(9,10)11/h2,14H,1H2
InChIKeyUGURITGZOAFUSX-UHFFFAOYSA-N
XLogP2.76
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.01
LogP ≤ 52.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

5-(chloromethyl)-4-iodo-2-(trifluoromethoxy)pyridin-3-ol
CID 130111284
4-amino-5-(fluoromethyl)-2-(trifluoromethoxy)pyridin-3-ol
CID 118811668
4,5-diiodo-2-(trifluoromethoxy)pyridin-3-ol
CID 131059755
5-(fluoromethyl)-2-(hydroxymethyl)-4-(trifluoromethoxy)pyridin-3-ol
CID 134677273
5-(fluoromethyl)-4-iodo-3-(trifluoromethoxy)pyridine-2-carboxylic acid
CID 134667317
2-[4-(fluoromethyl)-5-iodo-6-(trifluoromethoxy)-3-pyridinyl]acetonitrile
CID 134667296
2-[4-bromo-5-iodo-6-(trifluoromethoxy)-3-pyridinyl]acetic acid
CID 118811704
[4-iodo-5-methyl-6-(trifluoromethoxy)-3-pyridinyl]methanamine
CID 130112708
4-(fluoromethyl)-3-iodo-5-methyl-2-(trifluoromethoxy)pyridine
CID 118840248
[5-iodo-6-methoxy-4-(trifluoromethoxy)-3-pyridinyl]methanol
CID 134660114
5-(fluoromethyl)-4-iodo-6-(trifluoromethoxy)pyridine-3-carbaldehyde
CID 134661619
ethyl 2-[4-(bromomethyl)-5-iodo-6-(trifluoromethoxy)-3-pyridinyl]acetate
CID 134676598

Frequently Asked Questions

What is the IUPAC name of 5-(fluoromethyl)-4-iodo-2-(trifluoromethoxy)pyridin-3-ol?
The IUPAC name of 5-(fluoromethyl)-4-iodo-2-(trifluoromethoxy)pyridin-3-ol (CID 130111324) is 5-(fluoromethyl)-4-iodo-2-(trifluoromethoxy)pyridin-3-ol.
What is the SMILES notation for 5-(fluoromethyl)-4-iodo-2-(trifluoromethoxy)pyridin-3-ol?
The canonical SMILES for 5-(fluoromethyl)-4-iodo-2-(trifluoromethoxy)pyridin-3-ol is Oc1c(OC(F)(F)F)ncc(CF)c1I.
What is the InChIKey of 5-(fluoromethyl)-4-iodo-2-(trifluoromethoxy)pyridin-3-ol?
The InChIKey is UGURITGZOAFUSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H4F4INO2/c8-1-3-2-13-6(5(14)4(3)12)15-7(9,10)11/h2,14H,1H2.
What are the key properties of 5-(fluoromethyl)-4-iodo-2-(trifluoromethoxy)pyridin-3-ol?
5-(fluoromethyl)-4-iodo-2-(trifluoromethoxy)pyridin-3-ol has a molecular weight of 337.01 g/mol, XLogP of 2.76, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(fluoromethyl)-4-iodo-2-(trifluoromethoxy)pyridin-3-ol is sourced from PubChem (CID 130111324), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).