5-fluoro-2,6-dimethoxypyridin-3-amine

C7H9FN2O2 — CID 150134011

IUPAC5-fluoro-2,6-dimethoxypyridin-3-amine
SMILESCOc1nc(OC)c(F)cc1N
InChIInChI=1S/C7H9FN2O2/c1-11-6-4(8)3-5(9)7(10-6)12-2/h3H,9H2,1-2H3
InChIKeyFBVSHWDROMCUFF-UHFFFAOYSA-N
MW172.16 g/mol
LogP0.82
Rot. Bonds2

About 5-fluoro-2,6-dimethoxypyridin-3-amine

5-fluoro-2,6-dimethoxypyridin-3-amine (PubChem CID 150134011) has the molecular formula C7H9FN2O2 and a molecular weight of 172.16 g/mol. Its IUPAC name is 5-fluoro-2,6-dimethoxypyridin-3-amine.

Molecular Properties

Compound Name5-fluoro-2,6-dimethoxypyridin-3-amine
PubChem CID150134011
Molecular FormulaC7H9FN2O2
Molecular Weight172.16 g/mol
Exact Mass172.06
IUPAC Name5-fluoro-2,6-dimethoxypyridin-3-amine
SMILESCOc1nc(OC)c(F)cc1N
InChIInChI=1S/C7H9FN2O2/c1-11-6-4(8)3-5(9)7(10-6)12-2/h3H,9H2,1-2H3
InChIKeyFBVSHWDROMCUFF-UHFFFAOYSA-N
XLogP0.82
TPSA57.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500172.16
LogP ≤ 50.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-fluoro-2,6-dimethoxypyridin-3-amine?
The IUPAC name of 5-fluoro-2,6-dimethoxypyridin-3-amine (CID 150134011) is 5-fluoro-2,6-dimethoxypyridin-3-amine.
What is the SMILES notation for 5-fluoro-2,6-dimethoxypyridin-3-amine?
The canonical SMILES for 5-fluoro-2,6-dimethoxypyridin-3-amine is COc1nc(OC)c(F)cc1N.
What is the InChIKey of 5-fluoro-2,6-dimethoxypyridin-3-amine?
The InChIKey is FBVSHWDROMCUFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9FN2O2/c1-11-6-4(8)3-5(9)7(10-6)12-2/h3H,9H2,1-2H3.
What are the key properties of 5-fluoro-2,6-dimethoxypyridin-3-amine?
5-fluoro-2,6-dimethoxypyridin-3-amine has a molecular weight of 172.16 g/mol, XLogP of 0.82, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-2,6-dimethoxypyridin-3-amine is sourced from PubChem (CID 150134011), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).