[(3R,4R,5R)-2,3-diphenyl-4-(trifluoromethyl)-1,2-oxazolidin-5-yl]methyl acetate

C19H18F3NO3 — CID 58618254

IUPAC[(3R,4R,5R)-2,3-diphenyl-4-(trifluoromethyl)-1,2-oxazolidin-5-yl]methyl acetate
SMILESCC(=O)OC[C@@H]1ON(c2ccccc2)[C@@H](c2ccccc2)[C@H]1C(F)(F)F
InChIInChI=1S/C19H18F3NO3/c1-13(24)25-12-16-17(19(20,21)22)18(14-8-4-2-5-9-14)23(26-16)15-10-6-3-7-11-15/h2-11,16-18H,12H2,1H3/t16-,17-,18-/m0/s1
InChIKeyUHJOWUKQYSJSDP-BZSNNMDCSA-N
MW365.35 g/mol
LogP4.29
Rot. Bonds4

About [(3R,4R,5R)-2,3-diphenyl-4-(trifluoromethyl)-1,2-oxazolidin-5-yl]methyl acetate

[(3R,4R,5R)-2,3-diphenyl-4-(trifluoromethyl)-1,2-oxazolidin-5-yl]methyl acetate (PubChem CID 58618254) has the molecular formula C19H18F3NO3 and a molecular weight of 365.35 g/mol. Its IUPAC name is [(3R,4R,5R)-2,3-diphenyl-4-(trifluoromethyl)-1,2-oxazolidin-5-yl]methyl acetate.

Molecular Properties

Compound Name[(3R,4R,5R)-2,3-diphenyl-4-(trifluoromethyl)-1,2-oxazolidin-5-yl]methyl acetate
PubChem CID58618254
Molecular FormulaC19H18F3NO3
Molecular Weight365.35 g/mol
Exact Mass365.12
IUPAC Name[(3R,4R,5R)-2,3-diphenyl-4-(trifluoromethyl)-1,2-oxazolidin-5-yl]methyl acetate
SMILESCC(=O)OC[C@@H]1ON(c2ccccc2)[C@@H](c2ccccc2)[C@H]1C(F)(F)F
InChIInChI=1S/C19H18F3NO3/c1-13(24)25-12-16-17(19(20,21)22)18(14-8-4-2-5-9-14)23(26-16)15-10-6-3-7-11-15/h2-11,16-18H,12H2,1H3/t16-,17-,18-/m0/s1
InChIKeyUHJOWUKQYSJSDP-BZSNNMDCSA-N
XLogP4.29
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.35
LogP ≤ 54.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze [(3R,4R,5R)-2,3-diphenyl-4-(trifluoromethyl)-1,2-oxazolidin-5-yl]methyl acetate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of [(3R,4R,5R)-2,3-diphenyl-4-(trifluoromethyl)-1,2-oxazolidin-5-yl]methyl acetate?
The IUPAC name of [(3R,4R,5R)-2,3-diphenyl-4-(trifluoromethyl)-1,2-oxazolidin-5-yl]methyl acetate (CID 58618254) is [(3R,4R,5R)-2,3-diphenyl-4-(trifluoromethyl)-1,2-oxazolidin-5-yl]methyl acetate.
What is the SMILES notation for [(3R,4R,5R)-2,3-diphenyl-4-(trifluoromethyl)-1,2-oxazolidin-5-yl]methyl acetate?
The canonical SMILES for [(3R,4R,5R)-2,3-diphenyl-4-(trifluoromethyl)-1,2-oxazolidin-5-yl]methyl acetate is CC(=O)OC[C@@H]1ON(c2ccccc2)[C@@H](c2ccccc2)[C@H]1C(F)(F)F.
What is the InChIKey of [(3R,4R,5R)-2,3-diphenyl-4-(trifluoromethyl)-1,2-oxazolidin-5-yl]methyl acetate?
The InChIKey is UHJOWUKQYSJSDP-BZSNNMDCSA-N. The full InChI is InChI=1S/C19H18F3NO3/c1-13(24)25-12-16-17(19(20,21)22)18(14-8-4-2-5-9-14)23(26-16)15-10-6-3-7-11-15/h2-11,16-18H,12H2,1H3/t16-,17-,18-/m0/s1.
What are the key properties of [(3R,4R,5R)-2,3-diphenyl-4-(trifluoromethyl)-1,2-oxazolidin-5-yl]methyl acetate?
[(3R,4R,5R)-2,3-diphenyl-4-(trifluoromethyl)-1,2-oxazolidin-5-yl]methyl acetate has a molecular weight of 365.35 g/mol, XLogP of 4.29, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [(3R,4R,5R)-2,3-diphenyl-4-(trifluoromethyl)-1,2-oxazolidin-5-yl]methyl acetate is sourced from PubChem (CID 58618254), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).