6-bromo-5-iodo-2-(trifluoromethoxy)pyridin-3-ol

C6H2BrF3INO2 — CID 130909745

IUPAC6-bromo-5-iodo-2-(trifluoromethoxy)pyridin-3-ol
SMILESOc1cc(I)c(Br)nc1OC(F)(F)F
InChIInChI=1S/C6H2BrF3INO2/c7-4-2(11)1-3(13)5(12-4)14-6(8,9)10/h1,13H
InChIKeyFTVLZJYQYVFCFT-UHFFFAOYSA-N
MW383.89 g/mol
LogP3.05
Rot. Bonds1

About 6-bromo-5-iodo-2-(trifluoromethoxy)pyridin-3-ol

6-bromo-5-iodo-2-(trifluoromethoxy)pyridin-3-ol (PubChem CID 130909745) has the molecular formula C6H2BrF3INO2 and a molecular weight of 383.89 g/mol. Its IUPAC name is 6-bromo-5-iodo-2-(trifluoromethoxy)pyridin-3-ol.

Molecular Properties

Compound Name6-bromo-5-iodo-2-(trifluoromethoxy)pyridin-3-ol
PubChem CID130909745
Molecular FormulaC6H2BrF3INO2
Molecular Weight383.89 g/mol
Exact Mass382.83
IUPAC Name6-bromo-5-iodo-2-(trifluoromethoxy)pyridin-3-ol
SMILESOc1cc(I)c(Br)nc1OC(F)(F)F
InChIInChI=1S/C6H2BrF3INO2/c7-4-2(11)1-3(13)5(12-4)14-6(8,9)10/h1,13H
InChIKeyFTVLZJYQYVFCFT-UHFFFAOYSA-N
XLogP3.05
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500383.89
LogP ≤ 53.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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

2-[5-hydroxy-3-iodo-6-(trifluoromethoxy)-2-pyridinyl]acetic acid
CID 134680320
2-bromo-5-iodo-6-(trifluoromethoxy)pyridine-3-carbonitrile
CID 133094814
3-bromo-5-hydroxy-6-(trifluoromethoxy)pyridine-2-carbonitrile
CID 131443409
5-(chloromethyl)-6-iodo-2-(trifluoromethoxy)pyridin-3-ol
CID 130111282
6-bromo-5-iodo-3-(trifluoromethoxy)pyridine-2-carbonitrile
CID 119012441
6-(chloromethyl)-4-iodo-2-(trifluoromethoxy)pyridin-3-ol
CID 130111265
5-hydroxy-4-iodo-6-(trifluoromethoxy)pyridine-2-carbaldehyde
CID 130111506
3-bromo-6-chloro-4-iodo-2-(trifluoromethoxy)pyridine
CID 130934949
4,6-dibromo-3-iodo-2-(trifluoromethoxy)pyridine
CID 118812318
3-bromo-4-fluoro-6-iodo-2-(trifluoromethoxy)pyridine
CID 131118784
6-(aminomethyl)-2-(trifluoromethoxy)-5-(trifluoromethyl)pyridin-3-ol
CID 134680204
5-amino-2-bromo-6-(trifluoromethoxy)pyridine-3-carbonitrile
CID 131279561

Frequently Asked Questions

What is the IUPAC name of 6-bromo-5-iodo-2-(trifluoromethoxy)pyridin-3-ol?
The IUPAC name of 6-bromo-5-iodo-2-(trifluoromethoxy)pyridin-3-ol (CID 130909745) is 6-bromo-5-iodo-2-(trifluoromethoxy)pyridin-3-ol.
What is the SMILES notation for 6-bromo-5-iodo-2-(trifluoromethoxy)pyridin-3-ol?
The canonical SMILES for 6-bromo-5-iodo-2-(trifluoromethoxy)pyridin-3-ol is Oc1cc(I)c(Br)nc1OC(F)(F)F.
What is the InChIKey of 6-bromo-5-iodo-2-(trifluoromethoxy)pyridin-3-ol?
The InChIKey is FTVLZJYQYVFCFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H2BrF3INO2/c7-4-2(11)1-3(13)5(12-4)14-6(8,9)10/h1,13H.
What are the key properties of 6-bromo-5-iodo-2-(trifluoromethoxy)pyridin-3-ol?
6-bromo-5-iodo-2-(trifluoromethoxy)pyridin-3-ol has a molecular weight of 383.89 g/mol, XLogP of 3.05, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-5-iodo-2-(trifluoromethoxy)pyridin-3-ol is sourced from PubChem (CID 130909745), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).