5-[3-(trifluoromethyl)phenyl]-1,3-oxazolidine-2,4-dione

C10H6F3NO3 — CID 13092013

IUPAC5-[3-(trifluoromethyl)phenyl]-1,3-oxazolidine-2,4-dione
SMILESO=C1NC(=O)C(c2cccc(C(F)(F)F)c2)O1
InChIInChI=1S/C10H6F3NO3/c11-10(12,13)6-3-1-2-5(4-6)7-8(15)14-9(16)17-7/h1-4,7H,(H,14,15,16)
InChIKeyFJLSWFYFARDZHG-UHFFFAOYSA-N
MW245.16 g/mol
LogP2.01
Rot. Bonds1

About 5-[3-(trifluoromethyl)phenyl]-1,3-oxazolidine-2,4-dione

5-[3-(trifluoromethyl)phenyl]-1,3-oxazolidine-2,4-dione (PubChem CID 13092013) has the molecular formula C10H6F3NO3 and a molecular weight of 245.16 g/mol. Its IUPAC name is 5-[3-(trifluoromethyl)phenyl]-1,3-oxazolidine-2,4-dione.

Molecular Properties

Compound Name5-[3-(trifluoromethyl)phenyl]-1,3-oxazolidine-2,4-dione
PubChem CID13092013
Molecular FormulaC10H6F3NO3
Molecular Weight245.16 g/mol
Exact Mass245.03
IUPAC Name5-[3-(trifluoromethyl)phenyl]-1,3-oxazolidine-2,4-dione
SMILESO=C1NC(=O)C(c2cccc(C(F)(F)F)c2)O1
InChIInChI=1S/C10H6F3NO3/c11-10(12,13)6-3-1-2-5(4-6)7-8(15)14-9(16)17-7/h1-4,7H,(H,14,15,16)
InChIKeyFJLSWFYFARDZHG-UHFFFAOYSA-N
XLogP2.01
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.16
LogP ≤ 52.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-methyl-5-[3-(trifluoromethyl)phenyl]-1,3-oxazolidin-2-one
CID 77401770
(5S)-5-[3-(trifluoromethyl)phenyl]-1,3-oxazolidin-2-one
CID 97000628
(4S)-4-[3-(trifluoromethyl)phenyl]-1,3-oxazinan-2-one
CID 171185732
4-[3-(trifluoromethyl)phenyl]-1,3-dioxolan-2-one
CID 102125689
4-[3-(trifluoromethyl)phenyl]-1,3,4,7-tetrahydrofuro[3,4-d]pyrimidine-2,5-dione
CID 3411631
2-[3-(trifluoromethyl)phenyl]-4H-1,4-benzothiazin-3-one
CID 14715205
2-[4,6-dioxo-3-[3-(trifluoromethyl)phenyl]-3a,6a-dihydro-3H-pyrrolo[3,4-d][1,2]oxazol-2-yl]acetamide
CID 3702012
1-cyclopropyl-3-(trifluoromethyl)benzene
CID 12509713
(4R)-4-[3-(trifluoromethyl)phenyl]oxolan-2-one
CID 71698017
2-[3-(trifluoromethyl)phenyl]-2,3-dihydrochromen-4-one
CID 114671510
1-methyl-4-[3-(trifluoromethyl)phenyl]imidazolidin-2-one
CID 90179148
2-ethyl-3-[3-(trifluoromethyl)phenyl]cyclobutan-1-one
CID 81416408

Frequently Asked Questions

What is the IUPAC name of 5-[3-(trifluoromethyl)phenyl]-1,3-oxazolidine-2,4-dione?
The IUPAC name of 5-[3-(trifluoromethyl)phenyl]-1,3-oxazolidine-2,4-dione (CID 13092013) is 5-[3-(trifluoromethyl)phenyl]-1,3-oxazolidine-2,4-dione.
What is the SMILES notation for 5-[3-(trifluoromethyl)phenyl]-1,3-oxazolidine-2,4-dione?
The canonical SMILES for 5-[3-(trifluoromethyl)phenyl]-1,3-oxazolidine-2,4-dione is O=C1NC(=O)C(c2cccc(C(F)(F)F)c2)O1.
What is the InChIKey of 5-[3-(trifluoromethyl)phenyl]-1,3-oxazolidine-2,4-dione?
The InChIKey is FJLSWFYFARDZHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H6F3NO3/c11-10(12,13)6-3-1-2-5(4-6)7-8(15)14-9(16)17-7/h1-4,7H,(H,14,15,16).
What are the key properties of 5-[3-(trifluoromethyl)phenyl]-1,3-oxazolidine-2,4-dione?
5-[3-(trifluoromethyl)phenyl]-1,3-oxazolidine-2,4-dione has a molecular weight of 245.16 g/mol, XLogP of 2.01, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[3-(trifluoromethyl)phenyl]-1,3-oxazolidine-2,4-dione is sourced from PubChem (CID 13092013), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).