2,3,4-trifluoro-N-[(3-methyl-2-oxo-1,3-oxazolidin-5-yl)methyl]benzamide

C12H11F3N2O3 — CID 110710361

IUPAC2,3,4-trifluoro-N-[(3-methyl-2-oxo-1,3-oxazolidin-5-yl)methyl]benzamide
SMILESCN1CC(CNC(=O)c2ccc(F)c(F)c2F)OC1=O
InChIInChI=1S/C12H11F3N2O3/c1-17-5-6(20-12(17)19)4-16-11(18)7-2-3-8(13)10(15)9(7)14/h2-3,6H,4-5H2,1H3,(H,16,18)
InChIKeyQIEKCDXMWRQOED-UHFFFAOYSA-N
MW288.23 g/mol
LogP1.28
Rot. Bonds3

About 2,3,4-trifluoro-N-[(3-methyl-2-oxo-1,3-oxazolidin-5-yl)methyl]benzamide

2,3,4-trifluoro-N-[(3-methyl-2-oxo-1,3-oxazolidin-5-yl)methyl]benzamide (PubChem CID 110710361) has the molecular formula C12H11F3N2O3 and a molecular weight of 288.23 g/mol. Its IUPAC name is 2,3,4-trifluoro-N-[(3-methyl-2-oxo-1,3-oxazolidin-5-yl)methyl]benzamide.

Molecular Properties

Compound Name2,3,4-trifluoro-N-[(3-methyl-2-oxo-1,3-oxazolidin-5-yl)methyl]benzamide
PubChem CID110710361
Molecular FormulaC12H11F3N2O3
Molecular Weight288.23 g/mol
Exact Mass288.07
IUPAC Name2,3,4-trifluoro-N-[(3-methyl-2-oxo-1,3-oxazolidin-5-yl)methyl]benzamide
SMILESCN1CC(CNC(=O)c2ccc(F)c(F)c2F)OC1=O
InChIInChI=1S/C12H11F3N2O3/c1-17-5-6(20-12(17)19)4-16-11(18)7-2-3-8(13)10(15)9(7)14/h2-3,6H,4-5H2,1H3,(H,16,18)
InChIKeyQIEKCDXMWRQOED-UHFFFAOYSA-N
XLogP1.28
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.23
LogP ≤ 51.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'halogenated_ring_2', 'substructure': 'N/A'}

Analyze 2,3,4-trifluoro-N-[(3-methyl-2-oxo-1,3-oxazolidin-5-yl)methyl]benzamide 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

2,3,4-trifluoro-N-[[3-(3-methoxyphenyl)-2-oxo-1,3-oxazolidin-5-yl]methyl]benzamide
CID 110327902
N-[(3-methyl-2-oxo-1,3-oxazolidin-5-yl)methyl]pyridine-4-carboxamide
CID 110710356
3-chloro-N-[(3-methyl-2-oxo-1,3-oxazolidin-5-yl)methyl]benzamide
CID 110710353
N-[(3-methyl-2-oxo-1,3-oxazolidin-5-yl)methyl]pyridine-2-carboxamide
CID 110741555
1-benzyl-3-[(3-methyl-2-oxo-1,3-oxazolidin-5-yl)methyl]urea
CID 110747054
N-[(1-acetylpiperidin-4-yl)methyl]-2,3,4-trifluorobenzamide
CID 110736173
2-(2-chlorophenyl)-N-[(3-methyl-2-oxo-1,3-oxazolidin-5-yl)methyl]acetamide
CID 110710393
3-(dimethylamino)-N-[(3-methyl-2-oxo-1,3-oxazolidin-5-yl)methyl]benzamide
CID 110741562
2-fluoro-N-[(2-oxo-3-phenyl-1,3-oxazolidin-5-yl)methyl]benzamide
CID 16920439
N-[(4-aminocyclohexyl)methyl]-2,3,4-trifluorobenzamide
CID 106124628
2-[[(2,3,4-trifluorobenzoyl)amino]methyl]cyclopentane-1-carboxylic acid
CID 79757270
(5S)-3-methyl-5-(methylaminomethyl)-1,3-oxazolidin-2-one
CID 59010162

Frequently Asked Questions

What is the IUPAC name of 2,3,4-trifluoro-N-[(3-methyl-2-oxo-1,3-oxazolidin-5-yl)methyl]benzamide?
The IUPAC name of 2,3,4-trifluoro-N-[(3-methyl-2-oxo-1,3-oxazolidin-5-yl)methyl]benzamide (CID 110710361) is 2,3,4-trifluoro-N-[(3-methyl-2-oxo-1,3-oxazolidin-5-yl)methyl]benzamide.
What is the SMILES notation for 2,3,4-trifluoro-N-[(3-methyl-2-oxo-1,3-oxazolidin-5-yl)methyl]benzamide?
The canonical SMILES for 2,3,4-trifluoro-N-[(3-methyl-2-oxo-1,3-oxazolidin-5-yl)methyl]benzamide is CN1CC(CNC(=O)c2ccc(F)c(F)c2F)OC1=O.
What is the InChIKey of 2,3,4-trifluoro-N-[(3-methyl-2-oxo-1,3-oxazolidin-5-yl)methyl]benzamide?
The InChIKey is QIEKCDXMWRQOED-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11F3N2O3/c1-17-5-6(20-12(17)19)4-16-11(18)7-2-3-8(13)10(15)9(7)14/h2-3,6H,4-5H2,1H3,(H,16,18).
What are the key properties of 2,3,4-trifluoro-N-[(3-methyl-2-oxo-1,3-oxazolidin-5-yl)methyl]benzamide?
2,3,4-trifluoro-N-[(3-methyl-2-oxo-1,3-oxazolidin-5-yl)methyl]benzamide has a molecular weight of 288.23 g/mol, XLogP of 1.28, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3,4-trifluoro-N-[(3-methyl-2-oxo-1,3-oxazolidin-5-yl)methyl]benzamide is sourced from PubChem (CID 110710361), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).