[5-fluoro-4-(trifluoromethyl)-2-pyridinyl]methanol

C7H5F4NO — CID 131009331

IUPAC[5-fluoro-4-(trifluoromethyl)-2-pyridinyl]methanol
SMILESOCc1cc(C(F)(F)F)c(F)cn1
InChIInChI=1S/C7H5F4NO/c8-6-2-12-4(3-13)1-5(6)7(9,10)11/h1-2,13H,3H2
InChIKeyJKLUQOFENKHSGE-UHFFFAOYSA-N
MW195.11 g/mol
LogP1.73
Rot. Bonds1

About [5-fluoro-4-(trifluoromethyl)-2-pyridinyl]methanol

[5-fluoro-4-(trifluoromethyl)-2-pyridinyl]methanol (PubChem CID 131009331) has the molecular formula C7H5F4NO and a molecular weight of 195.11 g/mol. Its IUPAC name is [5-fluoro-4-(trifluoromethyl)-2-pyridinyl]methanol.

Molecular Properties

Compound Name[5-fluoro-4-(trifluoromethyl)-2-pyridinyl]methanol
PubChem CID131009331
Molecular FormulaC7H5F4NO
Molecular Weight195.11 g/mol
Exact Mass195.03
IUPAC Name[5-fluoro-4-(trifluoromethyl)-2-pyridinyl]methanol
SMILESOCc1cc(C(F)(F)F)c(F)cn1
InChIInChI=1S/C7H5F4NO/c8-6-2-12-4(3-13)1-5(6)7(9,10)11/h1-2,13H,3H2
InChIKeyJKLUQOFENKHSGE-UHFFFAOYSA-N
XLogP1.73
TPSA33.12 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.11
LogP ≤ 51.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[5-(difluoromethyl)-4-fluoro-2-pyridinyl]methanol
CID 130096445
[2-fluoro-5-(trifluoromethyl)-4-pyridinyl]methanol
CID 118704338
5-fluoro-N-methyl-4-(trifluoromethyl)pyridin-2-amine
CID 178093287
[5-fluoro-3-(trifluoromethyl)-2-pyridinyl]methanol
CID 84820125
[4,6-bis(trifluoromethyl)-3-pyridinyl]methanol
CID 131282987
[5-(aminomethyl)-2-fluoro-4-(trifluoromethyl)phenyl]methanol
CID 142503568
[4-chloro-2-fluoro-5-(trifluoromethyl)phenyl]methanol
CID 171009321
[5-iodo-4-(trifluoromethyl)-2-pyridinyl]methanamine
CID 130849064
2-[5-hydroxy-4-(trifluoromethyl)-2-pyridinyl]acetonitrile
CID 131169285
(4,5-dimethyl-2-pyridinyl)methanol
CID 14296060
2-(chloromethyl)-5-propan-2-yl-4-(trifluoromethyl)pyridine
CID 176930322
5-fluoro-4-(hydroxymethyl)-2-(trifluoromethyl)benzonitrile
CID 131583247

Frequently Asked Questions

What is the IUPAC name of [5-fluoro-4-(trifluoromethyl)-2-pyridinyl]methanol?
The IUPAC name of [5-fluoro-4-(trifluoromethyl)-2-pyridinyl]methanol (CID 131009331) is [5-fluoro-4-(trifluoromethyl)-2-pyridinyl]methanol.
What is the SMILES notation for [5-fluoro-4-(trifluoromethyl)-2-pyridinyl]methanol?
The canonical SMILES for [5-fluoro-4-(trifluoromethyl)-2-pyridinyl]methanol is OCc1cc(C(F)(F)F)c(F)cn1.
What is the InChIKey of [5-fluoro-4-(trifluoromethyl)-2-pyridinyl]methanol?
The InChIKey is JKLUQOFENKHSGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H5F4NO/c8-6-2-12-4(3-13)1-5(6)7(9,10)11/h1-2,13H,3H2.
What are the key properties of [5-fluoro-4-(trifluoromethyl)-2-pyridinyl]methanol?
[5-fluoro-4-(trifluoromethyl)-2-pyridinyl]methanol has a molecular weight of 195.11 g/mol, XLogP of 1.73, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [5-fluoro-4-(trifluoromethyl)-2-pyridinyl]methanol is sourced from PubChem (CID 131009331), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).