3-bromo-5-(1,2,2,2-tetrafluoroethoxy)pyridine

C7H4BrF4NO — CID 175443421

IUPAC3-bromo-5-(1,2,2,2-tetrafluoroethoxy)pyridine
SMILESFC(Oc1cncc(Br)c1)C(F)(F)F
InChIInChI=1S/C7H4BrF4NO/c8-4-1-5(3-13-2-4)14-6(9)7(10,11)12/h1-3,6H
InChIKeyQBUDSTIMGOSSJV-UHFFFAOYSA-N
MW274.01 g/mol
LogP3.08
Rot. Bonds2

About 3-bromo-5-(1,2,2,2-tetrafluoroethoxy)pyridine

3-bromo-5-(1,2,2,2-tetrafluoroethoxy)pyridine (PubChem CID 175443421) has the molecular formula C7H4BrF4NO and a molecular weight of 274.01 g/mol. Its IUPAC name is 3-bromo-5-(1,2,2,2-tetrafluoroethoxy)pyridine.

Molecular Properties

Compound Name3-bromo-5-(1,2,2,2-tetrafluoroethoxy)pyridine
PubChem CID175443421
Molecular FormulaC7H4BrF4NO
Molecular Weight274.01 g/mol
Exact Mass272.94
IUPAC Name3-bromo-5-(1,2,2,2-tetrafluoroethoxy)pyridine
SMILESFC(Oc1cncc(Br)c1)C(F)(F)F
InChIInChI=1S/C7H4BrF4NO/c8-4-1-5(3-13-2-4)14-6(9)7(10,11)12/h1-3,6H
InChIKeyQBUDSTIMGOSSJV-UHFFFAOYSA-N
XLogP3.08
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.01
LogP ≤ 53.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3-bromo-5-(1,1,2,2-tetrafluoropropoxy)pyridine
CID 158842641
3-bromo-5-propan-2-yloxypyridine;5-propan-2-yloxypyridin-3-amine
CID 158462322
3-bromo-5-[(1R)-1-(2,6-dichlorophenyl)ethoxy]pyridine
CID 141396943
3-[(5-bromo-3-pyridinyl)oxy]butan-1-ol
CID 174205406
3-bromo-5-(1-ethoxypropan-2-yloxy)pyridine
CID 103488077
methyl (2S)-2-[(5-bromo-3-pyridinyl)oxy]propanoate
CID 103338044
(1R)-1-(5-bromo-3-pyridinyl)-2,2,2-trifluoroethanol
CID 86335057
3-bromo-5-[2-(trifluoromethoxy)phenoxy]pyridine
CID 113497399
2-[(5-bromo-3-pyridinyl)oxy]-2-phenylacetonitrile
CID 129319703
(2S)-1-[(5-bromo-3-pyridinyl)oxy]propan-2-ol
CID 106933139
(2R)-1-[(5-bromo-3-pyridinyl)oxy]propan-2-ol
CID 106933138
3-(5-bromo-3-pyridinyl)-1,1,1-trifluoropropan-2-ol
CID 104800052

Frequently Asked Questions

What is the IUPAC name of 3-bromo-5-(1,2,2,2-tetrafluoroethoxy)pyridine?
The IUPAC name of 3-bromo-5-(1,2,2,2-tetrafluoroethoxy)pyridine (CID 175443421) is 3-bromo-5-(1,2,2,2-tetrafluoroethoxy)pyridine.
What is the SMILES notation for 3-bromo-5-(1,2,2,2-tetrafluoroethoxy)pyridine?
The canonical SMILES for 3-bromo-5-(1,2,2,2-tetrafluoroethoxy)pyridine is FC(Oc1cncc(Br)c1)C(F)(F)F.
What is the InChIKey of 3-bromo-5-(1,2,2,2-tetrafluoroethoxy)pyridine?
The InChIKey is QBUDSTIMGOSSJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H4BrF4NO/c8-4-1-5(3-13-2-4)14-6(9)7(10,11)12/h1-3,6H.
What are the key properties of 3-bromo-5-(1,2,2,2-tetrafluoroethoxy)pyridine?
3-bromo-5-(1,2,2,2-tetrafluoroethoxy)pyridine has a molecular weight of 274.01 g/mol, XLogP of 3.08, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-bromo-5-(1,2,2,2-tetrafluoroethoxy)pyridine is sourced from PubChem (CID 175443421), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).