2-[2,5,6-tris(fluoromethyl)-3-pyridinyl]ethanol

C10H12F3NO — CID 154316845

IUPAC2-[2,5,6-tris(fluoromethyl)-3-pyridinyl]ethanol
SMILESOCCc1cc(CF)c(CF)nc1CF
InChIInChI=1S/C10H12F3NO/c11-4-8-3-7(1-2-15)9(5-12)14-10(8)6-13/h3,15H,1-2,4-6H2
InChIKeyWMVKYRSZWZUWGN-UHFFFAOYSA-N
MW219.21 g/mol
LogP2.02
Rot. Bonds5

About 2-[2,5,6-tris(fluoromethyl)-3-pyridinyl]ethanol

2-[2,5,6-tris(fluoromethyl)-3-pyridinyl]ethanol (PubChem CID 154316845) has the molecular formula C10H12F3NO and a molecular weight of 219.21 g/mol. Its IUPAC name is 2-[2,5,6-tris(fluoromethyl)-3-pyridinyl]ethanol.

Molecular Properties

Compound Name2-[2,5,6-tris(fluoromethyl)-3-pyridinyl]ethanol
PubChem CID154316845
Molecular FormulaC10H12F3NO
Molecular Weight219.21 g/mol
Exact Mass219.09
IUPAC Name2-[2,5,6-tris(fluoromethyl)-3-pyridinyl]ethanol
SMILESOCCc1cc(CF)c(CF)nc1CF
InChIInChI=1S/C10H12F3NO/c11-4-8-3-7(1-2-15)9(5-12)14-10(8)6-13/h3,15H,1-2,4-6H2
InChIKeyWMVKYRSZWZUWGN-UHFFFAOYSA-N
XLogP2.02
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.21
LogP ≤ 52.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2,4,5-tris(fluoromethyl)pyrimidine
CID 172695350
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2-[5-(2-hydroxyethyl)phenanthren-4-yl]ethanol
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2-[4-(2-hydroxyethyl)naphthalen-1-yl]ethanol
CID 12582392
1,2,3,4,5-pentakis(fluoromethyl)benzene
CID 57246019
2-(2-fluoro-5-pyrimidin-2-ylphenyl)ethanol
CID 142687411
2-(2-chloro-5-fluoro-3-pyridinyl)ethanol
CID 174218174
2-[2-bromo-5-(bromomethyl)-4-fluorophenyl]ethanol
CID 178075985

Frequently Asked Questions

What is the IUPAC name of 2-[2,5,6-tris(fluoromethyl)-3-pyridinyl]ethanol?
The IUPAC name of 2-[2,5,6-tris(fluoromethyl)-3-pyridinyl]ethanol (CID 154316845) is 2-[2,5,6-tris(fluoromethyl)-3-pyridinyl]ethanol.
What is the SMILES notation for 2-[2,5,6-tris(fluoromethyl)-3-pyridinyl]ethanol?
The canonical SMILES for 2-[2,5,6-tris(fluoromethyl)-3-pyridinyl]ethanol is OCCc1cc(CF)c(CF)nc1CF.
What is the InChIKey of 2-[2,5,6-tris(fluoromethyl)-3-pyridinyl]ethanol?
The InChIKey is WMVKYRSZWZUWGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12F3NO/c11-4-8-3-7(1-2-15)9(5-12)14-10(8)6-13/h3,15H,1-2,4-6H2.
What are the key properties of 2-[2,5,6-tris(fluoromethyl)-3-pyridinyl]ethanol?
2-[2,5,6-tris(fluoromethyl)-3-pyridinyl]ethanol has a molecular weight of 219.21 g/mol, XLogP of 2.02, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2,5,6-tris(fluoromethyl)-3-pyridinyl]ethanol is sourced from PubChem (CID 154316845), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).