2-(difluoromethyl)-6-methoxy-3,5-dimethylpyridine

C9H11F2NO — CID 130101210

IUPAC2-(difluoromethyl)-6-methoxy-3,5-dimethylpyridine
SMILESCOc1nc(C(F)F)c(C)cc1C
InChIInChI=1S/C9H11F2NO/c1-5-4-6(2)9(13-3)12-7(5)8(10)11/h4,8H,1-3H3
InChIKeyNGXYKAZUMYJXKB-UHFFFAOYSA-N
MW187.19 g/mol
LogP2.64
Rot. Bonds2

About 2-(difluoromethyl)-6-methoxy-3,5-dimethylpyridine

2-(difluoromethyl)-6-methoxy-3,5-dimethylpyridine (PubChem CID 130101210) has the molecular formula C9H11F2NO and a molecular weight of 187.19 g/mol. Its IUPAC name is 2-(difluoromethyl)-6-methoxy-3,5-dimethylpyridine.

Molecular Properties

Compound Name2-(difluoromethyl)-6-methoxy-3,5-dimethylpyridine
PubChem CID130101210
Molecular FormulaC9H11F2NO
Molecular Weight187.19 g/mol
Exact Mass187.08
IUPAC Name2-(difluoromethyl)-6-methoxy-3,5-dimethylpyridine
SMILESCOc1nc(C(F)F)c(C)cc1C
InChIInChI=1S/C9H11F2NO/c1-5-4-6(2)9(13-3)12-7(5)8(10)11/h4,8H,1-3H3
InChIKeyNGXYKAZUMYJXKB-UHFFFAOYSA-N
XLogP2.64
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.19
LogP ≤ 52.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 2-(difluoromethyl)-6-methoxy-3,5-dimethylpyridine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-(difluoromethyl)-6-methoxy-3,5-dimethylpyridine?
The IUPAC name of 2-(difluoromethyl)-6-methoxy-3,5-dimethylpyridine (CID 130101210) is 2-(difluoromethyl)-6-methoxy-3,5-dimethylpyridine.
What is the SMILES notation for 2-(difluoromethyl)-6-methoxy-3,5-dimethylpyridine?
The canonical SMILES for 2-(difluoromethyl)-6-methoxy-3,5-dimethylpyridine is COc1nc(C(F)F)c(C)cc1C.
What is the InChIKey of 2-(difluoromethyl)-6-methoxy-3,5-dimethylpyridine?
The InChIKey is NGXYKAZUMYJXKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11F2NO/c1-5-4-6(2)9(13-3)12-7(5)8(10)11/h4,8H,1-3H3.
What are the key properties of 2-(difluoromethyl)-6-methoxy-3,5-dimethylpyridine?
2-(difluoromethyl)-6-methoxy-3,5-dimethylpyridine has a molecular weight of 187.19 g/mol, XLogP of 2.64, 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-3,5-dimethylpyridine is sourced from PubChem (CID 130101210), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).