[(2S,5S)-2-(trifluoromethyl)-1,3-oxazolidin-5-yl]methanol

C5H8F3NO2 — CID 150736545

IUPAC[(2S,5S)-2-(trifluoromethyl)-1,3-oxazolidin-5-yl]methanol
SMILESOC[C@@H]1CN[C@H](C(F)(F)F)O1
InChIInChI=1S/C5H8F3NO2/c6-5(7,8)4-9-1-3(2-10)11-4/h3-4,9-10H,1-2H2/t3-,4-/m0/s1
InChIKeyJSYCMOBEIJZCEK-IMJSIDKUSA-N
MW171.12 g/mol
LogP-0.14
Rot. Bonds1

About [(2S,5S)-2-(trifluoromethyl)-1,3-oxazolidin-5-yl]methanol

[(2S,5S)-2-(trifluoromethyl)-1,3-oxazolidin-5-yl]methanol (PubChem CID 150736545) has the molecular formula C5H8F3NO2 and a molecular weight of 171.12 g/mol. Its IUPAC name is [(2S,5S)-2-(trifluoromethyl)-1,3-oxazolidin-5-yl]methanol.

Molecular Properties

Compound Name[(2S,5S)-2-(trifluoromethyl)-1,3-oxazolidin-5-yl]methanol
PubChem CID150736545
Molecular FormulaC5H8F3NO2
Molecular Weight171.12 g/mol
Exact Mass171.05
IUPAC Name[(2S,5S)-2-(trifluoromethyl)-1,3-oxazolidin-5-yl]methanol
SMILESOC[C@@H]1CN[C@H](C(F)(F)F)O1
InChIInChI=1S/C5H8F3NO2/c6-5(7,8)4-9-1-3(2-10)11-4/h3-4,9-10H,1-2H2/t3-,4-/m0/s1
InChIKeyJSYCMOBEIJZCEK-IMJSIDKUSA-N
XLogP-0.14
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.12
LogP ≤ 5-0.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [(2S,5S)-2-(trifluoromethyl)-1,3-oxazolidin-5-yl]methanol?
The IUPAC name of [(2S,5S)-2-(trifluoromethyl)-1,3-oxazolidin-5-yl]methanol (CID 150736545) is [(2S,5S)-2-(trifluoromethyl)-1,3-oxazolidin-5-yl]methanol.
What is the SMILES notation for [(2S,5S)-2-(trifluoromethyl)-1,3-oxazolidin-5-yl]methanol?
The canonical SMILES for [(2S,5S)-2-(trifluoromethyl)-1,3-oxazolidin-5-yl]methanol is OC[C@@H]1CN[C@H](C(F)(F)F)O1.
What is the InChIKey of [(2S,5S)-2-(trifluoromethyl)-1,3-oxazolidin-5-yl]methanol?
The InChIKey is JSYCMOBEIJZCEK-IMJSIDKUSA-N. The full InChI is InChI=1S/C5H8F3NO2/c6-5(7,8)4-9-1-3(2-10)11-4/h3-4,9-10H,1-2H2/t3-,4-/m0/s1.
What are the key properties of [(2S,5S)-2-(trifluoromethyl)-1,3-oxazolidin-5-yl]methanol?
[(2S,5S)-2-(trifluoromethyl)-1,3-oxazolidin-5-yl]methanol has a molecular weight of 171.12 g/mol, XLogP of -0.14, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(2S,5S)-2-(trifluoromethyl)-1,3-oxazolidin-5-yl]methanol is sourced from PubChem (CID 150736545), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).