3-hydroxy-5-oxo-N-[2-(trifluoromethyl)phenyl]-1,2-oxazolidine-4-carboxamide

C11H9F3N2O4 — CID 142439171

IUPAC3-hydroxy-5-oxo-N-[2-(trifluoromethyl)phenyl]-1,2-oxazolidine-4-carboxamide
SMILESO=C(Nc1ccccc1C(F)(F)F)C1C(=O)ONC1O
InChIInChI=1S/C11H9F3N2O4/c12-11(13,14)5-3-1-2-4-6(5)15-8(17)7-9(18)16-20-10(7)19/h1-4,7,9,16,18H,(H,15,17)
InChIKeyABHMTIMGIDIPNU-UHFFFAOYSA-N
MW290.20 g/mol
LogP0.64
Rot. Bonds2

About 3-hydroxy-5-oxo-N-[2-(trifluoromethyl)phenyl]-1,2-oxazolidine-4-carboxamide

3-hydroxy-5-oxo-N-[2-(trifluoromethyl)phenyl]-1,2-oxazolidine-4-carboxamide (PubChem CID 142439171) has the molecular formula C11H9F3N2O4 and a molecular weight of 290.20 g/mol. Its IUPAC name is 3-hydroxy-5-oxo-N-[2-(trifluoromethyl)phenyl]-1,2-oxazolidine-4-carboxamide.

Molecular Properties

Compound Name3-hydroxy-5-oxo-N-[2-(trifluoromethyl)phenyl]-1,2-oxazolidine-4-carboxamide
PubChem CID142439171
Molecular FormulaC11H9F3N2O4
Molecular Weight290.20 g/mol
Exact Mass290.05
IUPAC Name3-hydroxy-5-oxo-N-[2-(trifluoromethyl)phenyl]-1,2-oxazolidine-4-carboxamide
SMILESO=C(Nc1ccccc1C(F)(F)F)C1C(=O)ONC1O
InChIInChI=1S/C11H9F3N2O4/c12-11(13,14)5-3-1-2-4-6(5)15-8(17)7-9(18)16-20-10(7)19/h1-4,7,9,16,18H,(H,15,17)
InChIKeyABHMTIMGIDIPNU-UHFFFAOYSA-N
XLogP0.64
TPSA87.66 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.20
LogP ≤ 50.64
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'beta-keto/anhydride', 'substructure': 'N/A'}

Analyze 3-hydroxy-5-oxo-N-[2-(trifluoromethyl)phenyl]-1,2-oxazolidine-4-carboxamide with MolForge

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

Launch Full Analysis

Related Compounds

(3R,4S)-4-(4-fluorophenyl)-2-oxo-N-[2-(trifluoromethyl)phenyl]oxolane-3-carboxamide
CID 157022192
N,N'-bis[2-(trifluoromethyl)phenyl]oxamide
CID 3696493
(1R,6R)-6-[[2-(trifluoromethyl)phenyl]carbamoyl]cyclohex-3-ene-1-carboxylic acid
CID 897574
2,2-dimethyl-3-[[2-(trifluoromethyl)phenyl]carbamoyl]cyclopropane-1-carboxylic acid
CID 64837457
N-[2-(trifluoromethyl)phenyl]carbamoyl chloride
CID 84820766
(3R,4S)-4-(3,5-dimethylphenyl)-2-oxo-N-[2-(trifluoromethyl)phenyl]pyrrolidine-3-carboxamide
CID 134411830
4-methyl-N-[2-(trifluoromethyl)phenyl]piperidine-2-carboxamide
CID 114422580
1-oxo-N-[2-(trifluoromethyl)phenyl]-3,4-dihydroisochromene-3-carboxamide
CID 5111630
(1S,2S,3R,4R)-3-[[2-(trifluoromethyl)phenyl]carbamoyl]-7-oxabicyclo[2.2.1]hept-5-ene-2-carboxylic acid
CID 99719754
trans-(1S,3S)-2,2-dichloro-3-phenyl-N-[2-(trifluoromethyl)phenyl]cyclopropane-1-carboxamide
CID 2177123
(1R,2S,3S,4R)-3-[[2-(trifluoromethyl)phenyl]carbamoyl]-7-oxabicyclo[2.2.1]hept-5-ene-2-carboxylic acid
CID 124719476
(4S,5R)-4-(2-chlorophenyl)-6-methylidene-2-oxo-N-[2-(trifluoromethyl)phenyl]-1,3-diazinane-5-carboxamide
CID 2445241

Frequently Asked Questions

What is the IUPAC name of 3-hydroxy-5-oxo-N-[2-(trifluoromethyl)phenyl]-1,2-oxazolidine-4-carboxamide?
The IUPAC name of 3-hydroxy-5-oxo-N-[2-(trifluoromethyl)phenyl]-1,2-oxazolidine-4-carboxamide (CID 142439171) is 3-hydroxy-5-oxo-N-[2-(trifluoromethyl)phenyl]-1,2-oxazolidine-4-carboxamide.
What is the SMILES notation for 3-hydroxy-5-oxo-N-[2-(trifluoromethyl)phenyl]-1,2-oxazolidine-4-carboxamide?
The canonical SMILES for 3-hydroxy-5-oxo-N-[2-(trifluoromethyl)phenyl]-1,2-oxazolidine-4-carboxamide is O=C(Nc1ccccc1C(F)(F)F)C1C(=O)ONC1O.
What is the InChIKey of 3-hydroxy-5-oxo-N-[2-(trifluoromethyl)phenyl]-1,2-oxazolidine-4-carboxamide?
The InChIKey is ABHMTIMGIDIPNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9F3N2O4/c12-11(13,14)5-3-1-2-4-6(5)15-8(17)7-9(18)16-20-10(7)19/h1-4,7,9,16,18H,(H,15,17).
What are the key properties of 3-hydroxy-5-oxo-N-[2-(trifluoromethyl)phenyl]-1,2-oxazolidine-4-carboxamide?
3-hydroxy-5-oxo-N-[2-(trifluoromethyl)phenyl]-1,2-oxazolidine-4-carboxamide has a molecular weight of 290.20 g/mol, XLogP of 0.64, 2 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-hydroxy-5-oxo-N-[2-(trifluoromethyl)phenyl]-1,2-oxazolidine-4-carboxamide is sourced from PubChem (CID 142439171), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).