6-amino-2-(difluoromethyl)-5-methoxypyridin-3-ol

C7H8F2N2O2 — CID 119007455

IUPAC6-amino-2-(difluoromethyl)-5-methoxypyridin-3-ol
SMILESCOc1cc(O)c(C(F)F)nc1N
InChIInChI=1S/C7H8F2N2O2/c1-13-4-2-3(12)5(6(8)9)11-7(4)10/h2,6,12H,1H3,(H2,10,11)
InChIKeyXJCYQCIIGASDIE-UHFFFAOYSA-N
MW190.15 g/mol
LogP1.32
Rot. Bonds2

About 6-amino-2-(difluoromethyl)-5-methoxypyridin-3-ol

6-amino-2-(difluoromethyl)-5-methoxypyridin-3-ol (PubChem CID 119007455) has the molecular formula C7H8F2N2O2 and a molecular weight of 190.15 g/mol. Its IUPAC name is 6-amino-2-(difluoromethyl)-5-methoxypyridin-3-ol.

Molecular Properties

Compound Name6-amino-2-(difluoromethyl)-5-methoxypyridin-3-ol
PubChem CID119007455
Molecular FormulaC7H8F2N2O2
Molecular Weight190.15 g/mol
Exact Mass190.06
IUPAC Name6-amino-2-(difluoromethyl)-5-methoxypyridin-3-ol
SMILESCOc1cc(O)c(C(F)F)nc1N
InChIInChI=1S/C7H8F2N2O2/c1-13-4-2-3(12)5(6(8)9)11-7(4)10/h2,6,12H,1H3,(H2,10,11)
InChIKeyXJCYQCIIGASDIE-UHFFFAOYSA-N
XLogP1.32
TPSA68.37 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.15
LogP ≤ 51.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-amino-2-(difluoromethyl)-5-methoxypyridin-3-ol?
The IUPAC name of 6-amino-2-(difluoromethyl)-5-methoxypyridin-3-ol (CID 119007455) is 6-amino-2-(difluoromethyl)-5-methoxypyridin-3-ol.
What is the SMILES notation for 6-amino-2-(difluoromethyl)-5-methoxypyridin-3-ol?
The canonical SMILES for 6-amino-2-(difluoromethyl)-5-methoxypyridin-3-ol is COc1cc(O)c(C(F)F)nc1N.
What is the InChIKey of 6-amino-2-(difluoromethyl)-5-methoxypyridin-3-ol?
The InChIKey is XJCYQCIIGASDIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8F2N2O2/c1-13-4-2-3(12)5(6(8)9)11-7(4)10/h2,6,12H,1H3,(H2,10,11).
What are the key properties of 6-amino-2-(difluoromethyl)-5-methoxypyridin-3-ol?
6-amino-2-(difluoromethyl)-5-methoxypyridin-3-ol has a molecular weight of 190.15 g/mol, XLogP of 1.32, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-2-(difluoromethyl)-5-methoxypyridin-3-ol is sourced from PubChem (CID 119007455), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).