2-(difluoromethyl)-6-methoxy-3-methylpyridine

C8H9F2NO — CID 130097304

IUPAC2-(difluoromethyl)-6-methoxy-3-methylpyridine
SMILESCOc1ccc(C)c(C(F)F)n1
InChIInChI=1S/C8H9F2NO/c1-5-3-4-6(12-2)11-7(5)8(9)10/h3-4,8H,1-2H3
InChIKeyCBKWFYXSYCXQDS-UHFFFAOYSA-N
MW173.16 g/mol
LogP2.34
Rot. Bonds2

About 2-(difluoromethyl)-6-methoxy-3-methylpyridine

2-(difluoromethyl)-6-methoxy-3-methylpyridine (PubChem CID 130097304) has the molecular formula C8H9F2NO and a molecular weight of 173.16 g/mol. Its IUPAC name is 2-(difluoromethyl)-6-methoxy-3-methylpyridine.

Molecular Properties

Compound Name2-(difluoromethyl)-6-methoxy-3-methylpyridine
PubChem CID130097304
Molecular FormulaC8H9F2NO
Molecular Weight173.16 g/mol
Exact Mass173.07
IUPAC Name2-(difluoromethyl)-6-methoxy-3-methylpyridine
SMILESCOc1ccc(C)c(C(F)F)n1
InChIInChI=1S/C8H9F2NO/c1-5-3-4-6(12-2)11-7(5)8(9)10/h3-4,8H,1-2H3
InChIKeyCBKWFYXSYCXQDS-UHFFFAOYSA-N
XLogP2.34
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.16
LogP ≤ 52.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(difluoromethyl)-6-methoxy-3-methylpyridine?
The IUPAC name of 2-(difluoromethyl)-6-methoxy-3-methylpyridine (CID 130097304) is 2-(difluoromethyl)-6-methoxy-3-methylpyridine.
What is the SMILES notation for 2-(difluoromethyl)-6-methoxy-3-methylpyridine?
The canonical SMILES for 2-(difluoromethyl)-6-methoxy-3-methylpyridine is COc1ccc(C)c(C(F)F)n1.
What is the InChIKey of 2-(difluoromethyl)-6-methoxy-3-methylpyridine?
The InChIKey is CBKWFYXSYCXQDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9F2NO/c1-5-3-4-6(12-2)11-7(5)8(9)10/h3-4,8H,1-2H3.
What are the key properties of 2-(difluoromethyl)-6-methoxy-3-methylpyridine?
2-(difluoromethyl)-6-methoxy-3-methylpyridine has a molecular weight of 173.16 g/mol, XLogP of 2.34, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(difluoromethyl)-6-methoxy-3-methylpyridine is sourced from PubChem (CID 130097304), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).