5-(difluoromethyl)-3,6-dimethoxypyridin-2-amine

C8H10F2N2O2 — CID 119013343

IUPAC5-(difluoromethyl)-3,6-dimethoxypyridin-2-amine
SMILESCOc1cc(C(F)F)c(OC)nc1N
InChIInChI=1S/C8H10F2N2O2/c1-13-5-3-4(6(9)10)8(14-2)12-7(5)11/h3,6H,1-2H3,(H2,11,12)
InChIKeyXWHFJAKMERJOCF-UHFFFAOYSA-N
MW204.18 g/mol
LogP1.62
Rot. Bonds3

About 5-(difluoromethyl)-3,6-dimethoxypyridin-2-amine

5-(difluoromethyl)-3,6-dimethoxypyridin-2-amine (PubChem CID 119013343) has the molecular formula C8H10F2N2O2 and a molecular weight of 204.18 g/mol. Its IUPAC name is 5-(difluoromethyl)-3,6-dimethoxypyridin-2-amine.

Molecular Properties

Compound Name5-(difluoromethyl)-3,6-dimethoxypyridin-2-amine
PubChem CID119013343
Molecular FormulaC8H10F2N2O2
Molecular Weight204.18 g/mol
Exact Mass204.07
IUPAC Name5-(difluoromethyl)-3,6-dimethoxypyridin-2-amine
SMILESCOc1cc(C(F)F)c(OC)nc1N
InChIInChI=1S/C8H10F2N2O2/c1-13-5-3-4(6(9)10)8(14-2)12-7(5)11/h3,6H,1-2H3,(H2,11,12)
InChIKeyXWHFJAKMERJOCF-UHFFFAOYSA-N
XLogP1.62
TPSA57.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.18
LogP ≤ 51.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-(difluoromethyl)-3,6-dimethoxypyridin-2-amine?
The IUPAC name of 5-(difluoromethyl)-3,6-dimethoxypyridin-2-amine (CID 119013343) is 5-(difluoromethyl)-3,6-dimethoxypyridin-2-amine.
What is the SMILES notation for 5-(difluoromethyl)-3,6-dimethoxypyridin-2-amine?
The canonical SMILES for 5-(difluoromethyl)-3,6-dimethoxypyridin-2-amine is COc1cc(C(F)F)c(OC)nc1N.
What is the InChIKey of 5-(difluoromethyl)-3,6-dimethoxypyridin-2-amine?
The InChIKey is XWHFJAKMERJOCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10F2N2O2/c1-13-5-3-4(6(9)10)8(14-2)12-7(5)11/h3,6H,1-2H3,(H2,11,12).
What are the key properties of 5-(difluoromethyl)-3,6-dimethoxypyridin-2-amine?
5-(difluoromethyl)-3,6-dimethoxypyridin-2-amine has a molecular weight of 204.18 g/mol, XLogP of 1.62, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(difluoromethyl)-3,6-dimethoxypyridin-2-amine is sourced from PubChem (CID 119013343), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).