methyl 6-methoxy-3-methyl-4-(trifluoromethoxy)pyridine-2-carboxylate

C10H10F3NO4 — CID 134666359

IUPACmethyl 6-methoxy-3-methyl-4-(trifluoromethoxy)pyridine-2-carboxylate
SMILESCOC(=O)c1nc(OC)cc(OC(F)(F)F)c1C
InChIInChI=1S/C10H10F3NO4/c1-5-6(18-10(11,12)13)4-7(16-2)14-8(5)9(15)17-3/h4H,1-3H3
InChIKeyWKSHWXUWKYSGOB-UHFFFAOYSA-N
MW265.19 g/mol
LogP2.08
Rot. Bonds3

About methyl 6-methoxy-3-methyl-4-(trifluoromethoxy)pyridine-2-carboxylate

methyl 6-methoxy-3-methyl-4-(trifluoromethoxy)pyridine-2-carboxylate (PubChem CID 134666359) has the molecular formula C10H10F3NO4 and a molecular weight of 265.19 g/mol. Its IUPAC name is methyl 6-methoxy-3-methyl-4-(trifluoromethoxy)pyridine-2-carboxylate.

Molecular Properties

Compound Namemethyl 6-methoxy-3-methyl-4-(trifluoromethoxy)pyridine-2-carboxylate
PubChem CID134666359
Molecular FormulaC10H10F3NO4
Molecular Weight265.19 g/mol
Exact Mass265.06
IUPAC Namemethyl 6-methoxy-3-methyl-4-(trifluoromethoxy)pyridine-2-carboxylate
SMILESCOC(=O)c1nc(OC)cc(OC(F)(F)F)c1C
InChIInChI=1S/C10H10F3NO4/c1-5-6(18-10(11,12)13)4-7(16-2)14-8(5)9(15)17-3/h4H,1-3H3
InChIKeyWKSHWXUWKYSGOB-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

6-methoxy-4-(trifluoromethoxy)-3-(trifluoromethyl)pyridine-2-carboxylic acid
CID 134676940
6-methoxy-3-methyl-4-(trifluoromethoxy)pyridine-2-sulfonyl chloride
CID 131314313
2-(chloromethyl)-6-methoxy-3-methyl-4-(trifluoromethoxy)pyridine
CID 130113375
methyl 3-hydroxy-4-methyl-5-(trifluoromethoxy)pyridine-2-carboxylate
CID 134679830
2-[6-methoxy-2-methyl-4-(trifluoromethoxy)-3-pyridinyl]acetic acid
CID 134670018
6-methoxy-4-methyl-3-(trifluoromethoxy)pyridine-2-carbonyl chloride
CID 134679364
methyl 6-methoxy-3-[4-(trifluoromethoxy)phenyl]pyridine-2-carboxylate
CID 134635686
methyl 4-(chloromethyl)-3-methoxy-6-(trifluoromethoxy)pyridine-2-carboxylate
CID 134668325
methyl 3-(difluoromethyl)-6-methoxy-5-(trifluoromethoxy)pyridine-2-carboxylate
CID 134677228
methyl 3-(aminomethyl)-6-methoxy-5-(trifluoromethoxy)pyridine-2-carboxylate
CID 134668833
methyl 6-amino-3-(aminomethyl)-4-(trifluoromethoxy)pyridine-2-carboxylate
CID 133085924
methyl 2-[3-(chloromethyl)-6-methoxy-4-(trifluoromethoxy)-2-pyridinyl]acetate
CID 134682639

Frequently Asked Questions

What is the IUPAC name of methyl 6-methoxy-3-methyl-4-(trifluoromethoxy)pyridine-2-carboxylate?
The IUPAC name of methyl 6-methoxy-3-methyl-4-(trifluoromethoxy)pyridine-2-carboxylate (CID 134666359) is methyl 6-methoxy-3-methyl-4-(trifluoromethoxy)pyridine-2-carboxylate.
What is the SMILES notation for methyl 6-methoxy-3-methyl-4-(trifluoromethoxy)pyridine-2-carboxylate?
The canonical SMILES for methyl 6-methoxy-3-methyl-4-(trifluoromethoxy)pyridine-2-carboxylate is COC(=O)c1nc(OC)cc(OC(F)(F)F)c1C.
What is the InChIKey of methyl 6-methoxy-3-methyl-4-(trifluoromethoxy)pyridine-2-carboxylate?
The InChIKey is WKSHWXUWKYSGOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10F3NO4/c1-5-6(18-10(11,12)13)4-7(16-2)14-8(5)9(15)17-3/h4H,1-3H3.
What are the key properties of methyl 6-methoxy-3-methyl-4-(trifluoromethoxy)pyridine-2-carboxylate?
methyl 6-methoxy-3-methyl-4-(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 6-methoxy-3-methyl-4-(trifluoromethoxy)pyridine-2-carboxylate is sourced from PubChem (CID 134666359), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).