5-(2-methoxyethoxy)-2-methyl-4-(trifluoromethyl)pyridine

C10H12F3NO2 — CID 121389108

IUPAC5-(2-methoxyethoxy)-2-methyl-4-(trifluoromethyl)pyridine
SMILESCOCCOc1cnc(C)cc1C(F)(F)F
InChIInChI=1S/C10H12F3NO2/c1-7-5-8(10(11,12)13)9(6-14-7)16-4-3-15-2/h5-6H,3-4H2,1-2H3
InChIKeyZTSJGXKAXYQICF-UHFFFAOYSA-N
MW235.20 g/mol
LogP2.43
Rot. Bonds4

About 5-(2-methoxyethoxy)-2-methyl-4-(trifluoromethyl)pyridine

5-(2-methoxyethoxy)-2-methyl-4-(trifluoromethyl)pyridine (PubChem CID 121389108) has the molecular formula C10H12F3NO2 and a molecular weight of 235.20 g/mol. Its IUPAC name is 5-(2-methoxyethoxy)-2-methyl-4-(trifluoromethyl)pyridine.

Molecular Properties

Compound Name5-(2-methoxyethoxy)-2-methyl-4-(trifluoromethyl)pyridine
PubChem CID121389108
Molecular FormulaC10H12F3NO2
Molecular Weight235.20 g/mol
Exact Mass235.08
IUPAC Name5-(2-methoxyethoxy)-2-methyl-4-(trifluoromethyl)pyridine
SMILESCOCCOc1cnc(C)cc1C(F)(F)F
InChIInChI=1S/C10H12F3NO2/c1-7-5-8(10(11,12)13)9(6-14-7)16-4-3-15-2/h5-6H,3-4H2,1-2H3
InChIKeyZTSJGXKAXYQICF-UHFFFAOYSA-N
XLogP2.43
TPSA31.35 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.20
LogP ≤ 52.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

1-fluoro-5-(2-methoxyethoxy)-2-methyl-4-(trifluoromethyl)benzene
CID 154985854
4-(2-methoxyethoxy)-3-(trifluoromethyl)phenol
CID 166611038
1-(2-methoxyethoxy)-2-(trifluoromethyl)benzene
CID 25185445
5-[2-[(2-methylpropan-2-yl)oxy]ethoxy]-2-propan-2-yl-4-(trifluoromethyl)pyridine
CID 144787153
4-(2-methoxyethoxy)-1-methyl-2-(trifluoromethyl)benzene
CID 20785482
2-propan-2-yl-5-propoxy-4-(trifluoromethyl)pyridine
CID 144787128
1-(2-methoxyethoxymethoxy)-4-methyl-2-(trifluoromethyl)benzene
CID 91496733
4-(3-methoxypropoxy)-3-(trifluoromethyl)benzoic acid
CID 55206438
2-methyl-4-[2-[2-(trifluoromethyl)phenoxy]ethoxy]pyridine
CID 100672590
N-[2-(2-methoxyethoxy)-5-(trifluoromethyl)phenyl]-5-methylpyrazine-2-carboxamide
CID 17439153
N-[[4-(2-methoxyethoxy)-6-methyl-3-pyridinyl]methyl]propan-1-amine
CID 81254724
4-(bromomethyl)-1-(3-methoxypropoxy)-2-(trifluoromethyl)benzene
CID 63320546

Frequently Asked Questions

What is the IUPAC name of 5-(2-methoxyethoxy)-2-methyl-4-(trifluoromethyl)pyridine?
The IUPAC name of 5-(2-methoxyethoxy)-2-methyl-4-(trifluoromethyl)pyridine (CID 121389108) is 5-(2-methoxyethoxy)-2-methyl-4-(trifluoromethyl)pyridine.
What is the SMILES notation for 5-(2-methoxyethoxy)-2-methyl-4-(trifluoromethyl)pyridine?
The canonical SMILES for 5-(2-methoxyethoxy)-2-methyl-4-(trifluoromethyl)pyridine is COCCOc1cnc(C)cc1C(F)(F)F.
What is the InChIKey of 5-(2-methoxyethoxy)-2-methyl-4-(trifluoromethyl)pyridine?
The InChIKey is ZTSJGXKAXYQICF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12F3NO2/c1-7-5-8(10(11,12)13)9(6-14-7)16-4-3-15-2/h5-6H,3-4H2,1-2H3.
What are the key properties of 5-(2-methoxyethoxy)-2-methyl-4-(trifluoromethyl)pyridine?
5-(2-methoxyethoxy)-2-methyl-4-(trifluoromethyl)pyridine has a molecular weight of 235.20 g/mol, XLogP of 2.43, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-methoxyethoxy)-2-methyl-4-(trifluoromethyl)pyridine is sourced from PubChem (CID 121389108), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).