2-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-6-methylpyridine

C9H7F6NO — CID 166449996

IUPAC2-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-6-methylpyridine
SMILESCc1cccc(OC(C(F)(F)F)C(F)(F)F)n1
InChIInChI=1S/C9H7F6NO/c1-5-3-2-4-6(16-5)17-7(8(10,11)12)9(13,14)15/h2-4,7H,1H3
InChIKeyUYBMKUAPEHAKTO-UHFFFAOYSA-N
MW259.15 g/mol
LogP3.26
Rot. Bonds2

About 2-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-6-methylpyridine

2-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-6-methylpyridine (PubChem CID 166449996) has the molecular formula C9H7F6NO and a molecular weight of 259.15 g/mol. Its IUPAC name is 2-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-6-methylpyridine.

Molecular Properties

Compound Name2-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-6-methylpyridine
PubChem CID166449996
Molecular FormulaC9H7F6NO
Molecular Weight259.15 g/mol
Exact Mass259.04
IUPAC Name2-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-6-methylpyridine
SMILESCc1cccc(OC(C(F)(F)F)C(F)(F)F)n1
InChIInChI=1S/C9H7F6NO/c1-5-3-2-4-6(16-5)17-7(8(10,11)12)9(13,14)15/h2-4,7H,1H3
InChIKeyUYBMKUAPEHAKTO-UHFFFAOYSA-N
XLogP3.26
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.15
LogP ≤ 53.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-Methoxy-6-(trifluoromethyl)pyridine
CID 46739474
2-Methoxy-6-methylpyridine
CID 5324773
6-Methoxy-2-pyridinecarbonitrile
CID 13023644
2-Methyl-6-phenylmethoxypyridine
CID 261829
Pyridine, 2-ethoxy-6-methyl-
CID 4738465
2-Ethynyl-6-methoxypyridine
CID 9877376
2-Fluoro-6-methoxypyridine
CID 14296367
[6-(2,2,2-Trifluoroethoxy)pyridin-2-yl]methanamine
CID 62290450
(6-(Tert-butoxy)pyridin-2-yl)methanamine
CID 62290744
2-{[6-(Trifluoromethyl)pyridin-2-yl]oxy}ethan-1-amine
CID 62347988
2-Methyl-6-(3-phenoxyprop-1-yn-1-yl)pyridine
CID 44415867
2-Piperidin-3-yloxy-6-(trifluoromethyl)pyridine
CID 62348720

Frequently Asked Questions

What is the IUPAC name of 2-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-6-methylpyridine?
The IUPAC name of 2-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-6-methylpyridine (CID 166449996) is 2-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-6-methylpyridine.
What is the SMILES notation for 2-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-6-methylpyridine?
The canonical SMILES for 2-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-6-methylpyridine is Cc1cccc(OC(C(F)(F)F)C(F)(F)F)n1.
What is the InChIKey of 2-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-6-methylpyridine?
The InChIKey is UYBMKUAPEHAKTO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H7F6NO/c1-5-3-2-4-6(16-5)17-7(8(10,11)12)9(13,14)15/h2-4,7H,1H3.
What are the key properties of 2-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-6-methylpyridine?
2-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-6-methylpyridine has a molecular weight of 259.15 g/mol, XLogP of 3.26, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1,1,1,3,3,3-hexafluoropropan-2-yloxy)-6-methylpyridine is sourced from PubChem (CID 166449996), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).