methyl 4-methoxy-6-methyl-5-(trifluoromethoxy)pyridine-2-carboxylate

C10H10F3NO4 — CID 134679723

IUPACmethyl 4-methoxy-6-methyl-5-(trifluoromethoxy)pyridine-2-carboxylate
SMILESCOC(=O)c1cc(OC)c(OC(F)(F)F)c(C)n1
InChIInChI=1S/C10H10F3NO4/c1-5-8(18-10(11,12)13)7(16-2)4-6(14-5)9(15)17-3/h4H,1-3H3
InChIKeyLBFXAVSYMUJMOW-UHFFFAOYSA-N
MW265.19 g/mol
LogP2.08
Rot. Bonds3

About methyl 4-methoxy-6-methyl-5-(trifluoromethoxy)pyridine-2-carboxylate

methyl 4-methoxy-6-methyl-5-(trifluoromethoxy)pyridine-2-carboxylate (PubChem CID 134679723) has the molecular formula C10H10F3NO4 and a molecular weight of 265.19 g/mol. Its IUPAC name is methyl 4-methoxy-6-methyl-5-(trifluoromethoxy)pyridine-2-carboxylate.

Molecular Properties

Compound Namemethyl 4-methoxy-6-methyl-5-(trifluoromethoxy)pyridine-2-carboxylate
PubChem CID134679723
Molecular FormulaC10H10F3NO4
Molecular Weight265.19 g/mol
Exact Mass265.06
IUPAC Namemethyl 4-methoxy-6-methyl-5-(trifluoromethoxy)pyridine-2-carboxylate
SMILESCOC(=O)c1cc(OC)c(OC(F)(F)F)c(C)n1
InChIInChI=1S/C10H10F3NO4/c1-5-8(18-10(11,12)13)7(16-2)4-6(14-5)9(15)17-3/h4H,1-3H3
InChIKeyLBFXAVSYMUJMOW-UHFFFAOYSA-N
XLogP2.08
TPSA57.65 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.19
LogP ≤ 52.08
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

ethyl 4-methoxy-6-methyl-5-(trifluoromethoxy)pyridine-2-carboxylate
CID 134663138
methyl 4-iodo-6-methyl-5-(trifluoromethoxy)pyridine-2-carboxylate
CID 134660206
ethyl 4-methoxy-5-(trifluoromethoxy)-6-(trifluoromethyl)pyridine-2-carboxylate
CID 134662339
methyl 5-(fluoromethyl)-4-methoxy-6-(trifluoromethoxy)pyridine-2-carboxylate
CID 134669852
[4-methoxy-6-methyl-5-(trifluoromethoxy)-2-pyridinyl]methanamine
CID 134670225
methyl 5-methoxy-2-methyl-6-(trifluoromethoxy)pyridine-3-carboxylate
CID 134670013
4-methoxy-2-methyl-6-nitro-3-(trifluoromethoxy)pyridine
CID 134668132
methyl 6-bromo-4,5-dimethoxypyridine-2-carboxylate
CID 86205250
methyl 4-(aminomethyl)-5-methoxy-6-(trifluoromethoxy)pyridine-2-carboxylate
CID 134668130
methyl 4-methyl-6-nitro-5-(trifluoromethoxy)pyridine-2-carboxylate
CID 134682984
6-(bromomethyl)-4-methoxy-5-(trifluoromethoxy)pyridine-2-carboxylic acid
CID 134665153
4-iodo-6-methyl-5-(trifluoromethoxy)pyridine-2-carbonyl chloride
CID 118816215

Frequently Asked Questions

What is the IUPAC name of methyl 4-methoxy-6-methyl-5-(trifluoromethoxy)pyridine-2-carboxylate?
The IUPAC name of methyl 4-methoxy-6-methyl-5-(trifluoromethoxy)pyridine-2-carboxylate (CID 134679723) is methyl 4-methoxy-6-methyl-5-(trifluoromethoxy)pyridine-2-carboxylate.
What is the SMILES notation for methyl 4-methoxy-6-methyl-5-(trifluoromethoxy)pyridine-2-carboxylate?
The canonical SMILES for methyl 4-methoxy-6-methyl-5-(trifluoromethoxy)pyridine-2-carboxylate is COC(=O)c1cc(OC)c(OC(F)(F)F)c(C)n1.
What is the InChIKey of methyl 4-methoxy-6-methyl-5-(trifluoromethoxy)pyridine-2-carboxylate?
The InChIKey is LBFXAVSYMUJMOW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10F3NO4/c1-5-8(18-10(11,12)13)7(16-2)4-6(14-5)9(15)17-3/h4H,1-3H3.
What are the key properties of methyl 4-methoxy-6-methyl-5-(trifluoromethoxy)pyridine-2-carboxylate?
methyl 4-methoxy-6-methyl-5-(trifluoromethoxy)pyridine-2-carboxylate has a molecular weight of 265.19 g/mol, XLogP of 2.08, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 4-methoxy-6-methyl-5-(trifluoromethoxy)pyridine-2-carboxylate is sourced from PubChem (CID 134679723), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).