[(4R)-4-phenyl-2-(trifluoromethyl)-1,3-oxazolidin-2-yl]methanol

C11H12F3NO2 — CID 56970084

IUPAC[(4R)-4-phenyl-2-(trifluoromethyl)-1,3-oxazolidin-2-yl]methanol
SMILESOCC1(C(F)(F)F)N[C@H](c2ccccc2)CO1
InChIInChI=1S/C11H12F3NO2/c12-11(13,14)10(7-16)15-9(6-17-10)8-4-2-1-3-5-8/h1-5,9,15-16H,6-7H2/t9-,10?/m0/s1
InChIKeyRCGLCODIOKCBAH-RGURZIINSA-N
MW247.22 g/mol
LogP1.60
Rot. Bonds2

About [(4R)-4-phenyl-2-(trifluoromethyl)-1,3-oxazolidin-2-yl]methanol

[(4R)-4-phenyl-2-(trifluoromethyl)-1,3-oxazolidin-2-yl]methanol (PubChem CID 56970084) has the molecular formula C11H12F3NO2 and a molecular weight of 247.22 g/mol. Its IUPAC name is [(4R)-4-phenyl-2-(trifluoromethyl)-1,3-oxazolidin-2-yl]methanol.

Molecular Properties

Compound Name[(4R)-4-phenyl-2-(trifluoromethyl)-1,3-oxazolidin-2-yl]methanol
PubChem CID56970084
Molecular FormulaC11H12F3NO2
Molecular Weight247.22 g/mol
Exact Mass247.08
IUPAC Name[(4R)-4-phenyl-2-(trifluoromethyl)-1,3-oxazolidin-2-yl]methanol
SMILESOCC1(C(F)(F)F)N[C@H](c2ccccc2)CO1
InChIInChI=1S/C11H12F3NO2/c12-11(13,14)10(7-16)15-9(6-17-10)8-4-2-1-3-5-8/h1-5,9,15-16H,6-7H2/t9-,10?/m0/s1
InChIKeyRCGLCODIOKCBAH-RGURZIINSA-N
XLogP1.60
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.22
LogP ≤ 51.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [(4R)-4-phenyl-2-(trifluoromethyl)-1,3-oxazolidin-2-yl]methanol?
The IUPAC name of [(4R)-4-phenyl-2-(trifluoromethyl)-1,3-oxazolidin-2-yl]methanol (CID 56970084) is [(4R)-4-phenyl-2-(trifluoromethyl)-1,3-oxazolidin-2-yl]methanol.
What is the SMILES notation for [(4R)-4-phenyl-2-(trifluoromethyl)-1,3-oxazolidin-2-yl]methanol?
The canonical SMILES for [(4R)-4-phenyl-2-(trifluoromethyl)-1,3-oxazolidin-2-yl]methanol is OCC1(C(F)(F)F)N[C@H](c2ccccc2)CO1.
What is the InChIKey of [(4R)-4-phenyl-2-(trifluoromethyl)-1,3-oxazolidin-2-yl]methanol?
The InChIKey is RCGLCODIOKCBAH-RGURZIINSA-N. The full InChI is InChI=1S/C11H12F3NO2/c12-11(13,14)10(7-16)15-9(6-17-10)8-4-2-1-3-5-8/h1-5,9,15-16H,6-7H2/t9-,10?/m0/s1.
What are the key properties of [(4R)-4-phenyl-2-(trifluoromethyl)-1,3-oxazolidin-2-yl]methanol?
[(4R)-4-phenyl-2-(trifluoromethyl)-1,3-oxazolidin-2-yl]methanol has a molecular weight of 247.22 g/mol, XLogP of 1.60, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(4R)-4-phenyl-2-(trifluoromethyl)-1,3-oxazolidin-2-yl]methanol is sourced from PubChem (CID 56970084), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).