2-butan-2-yloxy-6-(trifluoromethyl)pyridine

C10H12F3NO — CID 154485035

IUPAC2-butan-2-yloxy-6-(trifluoromethyl)pyridine
SMILESCCC(C)Oc1cccc(C(F)(F)F)n1
InChIInChI=1S/C10H12F3NO/c1-3-7(2)15-9-6-4-5-8(14-9)10(11,12)13/h4-7H,3H2,1-2H3
InChIKeySBCKMMZGFXZHOS-UHFFFAOYSA-N
MW219.21 g/mol
LogP3.28
Rot. Bonds3

About 2-butan-2-yloxy-6-(trifluoromethyl)pyridine

2-butan-2-yloxy-6-(trifluoromethyl)pyridine (PubChem CID 154485035) has the molecular formula C10H12F3NO and a molecular weight of 219.21 g/mol. Its IUPAC name is 2-butan-2-yloxy-6-(trifluoromethyl)pyridine.

Molecular Properties

Compound Name2-butan-2-yloxy-6-(trifluoromethyl)pyridine
PubChem CID154485035
Molecular FormulaC10H12F3NO
Molecular Weight219.21 g/mol
Exact Mass219.09
IUPAC Name2-butan-2-yloxy-6-(trifluoromethyl)pyridine
SMILESCCC(C)Oc1cccc(C(F)(F)F)n1
InChIInChI=1S/C10H12F3NO/c1-3-7(2)15-9-6-4-5-8(14-9)10(11,12)13/h4-7H,3H2,1-2H3
InChIKeySBCKMMZGFXZHOS-UHFFFAOYSA-N
XLogP3.28
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.21
LogP ≤ 53.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-Methoxy-6-(trifluoromethyl)pyridine
CID 46739474
[(6-Methoxypyridin-2-yl)methyl](methyl)amine
CID 58863294
2-(3-(4-Methoxyphenoxy)prop-1-ynyl)-6-methylpyridine
CID 11357227
2-Methoxy-6-methylpyridine
CID 5324773
6-Methoxy-2-pyridinecarbonitrile
CID 13023644
2-Methyl-6-phenylmethoxypyridine
CID 261829
5-Ethyl-4,6-dimethyl-2-methoxy pyridine
CID 6430781
Pyridine, 2-ethoxy-6-methyl-
CID 4738465
2-Ethynyl-6-methoxypyridine
CID 9877376
2-Fluoro-6-methoxypyridine
CID 14296367
(6-Methoxypyridin-2-yl)methanol
CID 12325389
(6-Methoxypyridin-2-yl)methanamine
CID 13882973

Frequently Asked Questions

What is the IUPAC name of 2-butan-2-yloxy-6-(trifluoromethyl)pyridine?
The IUPAC name of 2-butan-2-yloxy-6-(trifluoromethyl)pyridine (CID 154485035) is 2-butan-2-yloxy-6-(trifluoromethyl)pyridine.
What is the SMILES notation for 2-butan-2-yloxy-6-(trifluoromethyl)pyridine?
The canonical SMILES for 2-butan-2-yloxy-6-(trifluoromethyl)pyridine is CCC(C)Oc1cccc(C(F)(F)F)n1.
What is the InChIKey of 2-butan-2-yloxy-6-(trifluoromethyl)pyridine?
The InChIKey is SBCKMMZGFXZHOS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12F3NO/c1-3-7(2)15-9-6-4-5-8(14-9)10(11,12)13/h4-7H,3H2,1-2H3.
What are the key properties of 2-butan-2-yloxy-6-(trifluoromethyl)pyridine?
2-butan-2-yloxy-6-(trifluoromethyl)pyridine has a molecular weight of 219.21 g/mol, XLogP of 3.28, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-butan-2-yloxy-6-(trifluoromethyl)pyridine is sourced from PubChem (CID 154485035), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).