2-(difluoromethyl)-6-methoxy-5-methylpyridin-3-amine

C8H10F2N2O — CID 130105827

IUPAC2-(difluoromethyl)-6-methoxy-5-methylpyridin-3-amine
SMILESCOc1nc(C(F)F)c(N)cc1C
InChIInChI=1S/C8H10F2N2O/c1-4-3-5(11)6(7(9)10)12-8(4)13-2/h3,7H,11H2,1-2H3
InChIKeyXYHWUUXIKLZESF-UHFFFAOYSA-N
MW188.18 g/mol
LogP1.92
Rot. Bonds2

About 2-(difluoromethyl)-6-methoxy-5-methylpyridin-3-amine

2-(difluoromethyl)-6-methoxy-5-methylpyridin-3-amine (PubChem CID 130105827) has the molecular formula C8H10F2N2O and a molecular weight of 188.18 g/mol. Its IUPAC name is 2-(difluoromethyl)-6-methoxy-5-methylpyridin-3-amine.

Molecular Properties

Compound Name2-(difluoromethyl)-6-methoxy-5-methylpyridin-3-amine
PubChem CID130105827
Molecular FormulaC8H10F2N2O
Molecular Weight188.18 g/mol
Exact Mass188.08
IUPAC Name2-(difluoromethyl)-6-methoxy-5-methylpyridin-3-amine
SMILESCOc1nc(C(F)F)c(N)cc1C
InChIInChI=1S/C8H10F2N2O/c1-4-3-5(11)6(7(9)10)12-8(4)13-2/h3,7H,11H2,1-2H3
InChIKeyXYHWUUXIKLZESF-UHFFFAOYSA-N
XLogP1.92
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.18
LogP ≤ 51.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(difluoromethyl)-6-methoxy-5-methylpyridin-3-amine?
The IUPAC name of 2-(difluoromethyl)-6-methoxy-5-methylpyridin-3-amine (CID 130105827) is 2-(difluoromethyl)-6-methoxy-5-methylpyridin-3-amine.
What is the SMILES notation for 2-(difluoromethyl)-6-methoxy-5-methylpyridin-3-amine?
The canonical SMILES for 2-(difluoromethyl)-6-methoxy-5-methylpyridin-3-amine is COc1nc(C(F)F)c(N)cc1C.
What is the InChIKey of 2-(difluoromethyl)-6-methoxy-5-methylpyridin-3-amine?
The InChIKey is XYHWUUXIKLZESF-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10F2N2O/c1-4-3-5(11)6(7(9)10)12-8(4)13-2/h3,7H,11H2,1-2H3.
What are the key properties of 2-(difluoromethyl)-6-methoxy-5-methylpyridin-3-amine?
2-(difluoromethyl)-6-methoxy-5-methylpyridin-3-amine has a molecular weight of 188.18 g/mol, XLogP of 1.92, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(difluoromethyl)-6-methoxy-5-methylpyridin-3-amine is sourced from PubChem (CID 130105827), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).