5-bromo-6-methoxy-2-(trifluoromethoxy)pyridin-3-amine

C7H6BrF3N2O2 — CID 121269848

IUPAC5-bromo-6-methoxy-2-(trifluoromethoxy)pyridin-3-amine
SMILESCOc1nc(OC(F)(F)F)c(N)cc1Br
InChIInChI=1S/C7H6BrF3N2O2/c1-14-5-3(8)2-4(12)6(13-5)15-7(9,10)11/h2H,12H2,1H3
InChIKeyUWXRIMIBLOJOMN-UHFFFAOYSA-N
MW287.04 g/mol
LogP2.33
Rot. Bonds2

About 5-bromo-6-methoxy-2-(trifluoromethoxy)pyridin-3-amine

5-bromo-6-methoxy-2-(trifluoromethoxy)pyridin-3-amine (PubChem CID 121269848) has the molecular formula C7H6BrF3N2O2 and a molecular weight of 287.04 g/mol. Its IUPAC name is 5-bromo-6-methoxy-2-(trifluoromethoxy)pyridin-3-amine.

Molecular Properties

Compound Name5-bromo-6-methoxy-2-(trifluoromethoxy)pyridin-3-amine
PubChem CID121269848
Molecular FormulaC7H6BrF3N2O2
Molecular Weight287.04 g/mol
Exact Mass285.96
IUPAC Name5-bromo-6-methoxy-2-(trifluoromethoxy)pyridin-3-amine
SMILESCOc1nc(OC(F)(F)F)c(N)cc1Br
InChIInChI=1S/C7H6BrF3N2O2/c1-14-5-3(8)2-4(12)6(13-5)15-7(9,10)11/h2H,12H2,1H3
InChIKeyUWXRIMIBLOJOMN-UHFFFAOYSA-N
XLogP2.33
TPSA57.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.04
LogP ≤ 52.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-bromo-6-methoxy-2-(trifluoromethoxy)pyridin-3-amine?
The IUPAC name of 5-bromo-6-methoxy-2-(trifluoromethoxy)pyridin-3-amine (CID 121269848) is 5-bromo-6-methoxy-2-(trifluoromethoxy)pyridin-3-amine.
What is the SMILES notation for 5-bromo-6-methoxy-2-(trifluoromethoxy)pyridin-3-amine?
The canonical SMILES for 5-bromo-6-methoxy-2-(trifluoromethoxy)pyridin-3-amine is COc1nc(OC(F)(F)F)c(N)cc1Br.
What is the InChIKey of 5-bromo-6-methoxy-2-(trifluoromethoxy)pyridin-3-amine?
The InChIKey is UWXRIMIBLOJOMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6BrF3N2O2/c1-14-5-3(8)2-4(12)6(13-5)15-7(9,10)11/h2H,12H2,1H3.
What are the key properties of 5-bromo-6-methoxy-2-(trifluoromethoxy)pyridin-3-amine?
5-bromo-6-methoxy-2-(trifluoromethoxy)pyridin-3-amine has a molecular weight of 287.04 g/mol, XLogP of 2.33, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-6-methoxy-2-(trifluoromethoxy)pyridin-3-amine is sourced from PubChem (CID 121269848), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).