3-(5-ethyl-4-hydroxy-4,5-dimethyl-2-oxo-1,3-oxazolidin-3-yl)-N-(2-fluorophenyl)propanamide

C16H21FN2O4 — CID 5305223

IUPAC3-(5-ethyl-4-hydroxy-4,5-dimethyl-2-oxo-1,3-oxazolidin-3-yl)-N-(2-fluorophenyl)propanamide
SMILESCCC1(C)OC(=O)N(CCC(=O)Nc2ccccc2F)C1(C)O
InChIInChI=1S/C16H21FN2O4/c1-4-15(2)16(3,22)19(14(21)23-15)10-9-13(20)18-12-8-6-5-7-11(12)17/h5-8,22H,4,9-10H2,1-3H3,(H,18,20)
InChIKeyYDJBEMNIZFYAKR-UHFFFAOYSA-N
MW324.35 g/mol
LogP2.48
Rot. Bonds5

About 3-(5-ethyl-4-hydroxy-4,5-dimethyl-2-oxo-1,3-oxazolidin-3-yl)-N-(2-fluorophenyl)propanamide

3-(5-ethyl-4-hydroxy-4,5-dimethyl-2-oxo-1,3-oxazolidin-3-yl)-N-(2-fluorophenyl)propanamide (PubChem CID 5305223) has the molecular formula C16H21FN2O4 and a molecular weight of 324.35 g/mol. Its IUPAC name is 3-(5-ethyl-4-hydroxy-4,5-dimethyl-2-oxo-1,3-oxazolidin-3-yl)-N-(2-fluorophenyl)propanamide.

Molecular Properties

Compound Name3-(5-ethyl-4-hydroxy-4,5-dimethyl-2-oxo-1,3-oxazolidin-3-yl)-N-(2-fluorophenyl)propanamide
PubChem CID5305223
Molecular FormulaC16H21FN2O4
Molecular Weight324.35 g/mol
Exact Mass324.15
IUPAC Name3-(5-ethyl-4-hydroxy-4,5-dimethyl-2-oxo-1,3-oxazolidin-3-yl)-N-(2-fluorophenyl)propanamide
SMILESCCC1(C)OC(=O)N(CCC(=O)Nc2ccccc2F)C1(C)O
InChIInChI=1S/C16H21FN2O4/c1-4-15(2)16(3,22)19(14(21)23-15)10-9-13(20)18-12-8-6-5-7-11(12)17/h5-8,22H,4,9-10H2,1-3H3,(H,18,20)
InChIKeyYDJBEMNIZFYAKR-UHFFFAOYSA-N
XLogP2.48
TPSA78.87 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.35
LogP ≤ 52.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 3-(5-ethyl-4-hydroxy-4,5-dimethyl-2-oxo-1,3-oxazolidin-3-yl)-N-(2-fluorophenyl)propanamide 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

N-(2-fluorophenyl)-3-[(4R)-4-hydroxy-4,5,5-trimethyl-2-oxo-1,3-oxazolidin-3-yl]propanamide
CID 7354305
N-(2-fluorophenyl)butanamide
CID 849021
N-(2-fluorophenyl)-3-(3-hydroxy-3-methylpyrrolidin-1-yl)propanamide
CID 103728822
N-(2-fluorophenyl)hexanamide
CID 3481165
N-(2-fluorophenyl)-3-morpholin-4-ylpropanamide
CID 575001
4-(2-fluoroanilino)-4-oxobutanoic acid
CID 573893
N-(2-fluorophenyl)-3-(3-hydroxyazetidin-1-yl)propanamide
CID 63282550
3-[(3S,5S)-3,5-dimethylpiperidin-1-yl]-N-(2-fluorophenyl)propanamide
CID 740148
N-(2-fluorophenyl)-3-thiomorpholin-4-ylpropanamide
CID 91843372
N-(2-fluorophenyl)-4-hydrazinyl-4-oxobutanamide
CID 91820804
N-(2-fluorophenyl)-3-[(2-fluorophenyl)methyl-methylamino]propanamide
CID 24588973
11-(2,5-dioxopyrrolidin-1-yl)-N-(2-fluorophenyl)undecanamide
CID 17035126

Frequently Asked Questions

What is the IUPAC name of 3-(5-ethyl-4-hydroxy-4,5-dimethyl-2-oxo-1,3-oxazolidin-3-yl)-N-(2-fluorophenyl)propanamide?
The IUPAC name of 3-(5-ethyl-4-hydroxy-4,5-dimethyl-2-oxo-1,3-oxazolidin-3-yl)-N-(2-fluorophenyl)propanamide (CID 5305223) is 3-(5-ethyl-4-hydroxy-4,5-dimethyl-2-oxo-1,3-oxazolidin-3-yl)-N-(2-fluorophenyl)propanamide.
What is the SMILES notation for 3-(5-ethyl-4-hydroxy-4,5-dimethyl-2-oxo-1,3-oxazolidin-3-yl)-N-(2-fluorophenyl)propanamide?
The canonical SMILES for 3-(5-ethyl-4-hydroxy-4,5-dimethyl-2-oxo-1,3-oxazolidin-3-yl)-N-(2-fluorophenyl)propanamide is CCC1(C)OC(=O)N(CCC(=O)Nc2ccccc2F)C1(C)O.
What is the InChIKey of 3-(5-ethyl-4-hydroxy-4,5-dimethyl-2-oxo-1,3-oxazolidin-3-yl)-N-(2-fluorophenyl)propanamide?
The InChIKey is YDJBEMNIZFYAKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21FN2O4/c1-4-15(2)16(3,22)19(14(21)23-15)10-9-13(20)18-12-8-6-5-7-11(12)17/h5-8,22H,4,9-10H2,1-3H3,(H,18,20).
What are the key properties of 3-(5-ethyl-4-hydroxy-4,5-dimethyl-2-oxo-1,3-oxazolidin-3-yl)-N-(2-fluorophenyl)propanamide?
3-(5-ethyl-4-hydroxy-4,5-dimethyl-2-oxo-1,3-oxazolidin-3-yl)-N-(2-fluorophenyl)propanamide has a molecular weight of 324.35 g/mol, XLogP of 2.48, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(5-ethyl-4-hydroxy-4,5-dimethyl-2-oxo-1,3-oxazolidin-3-yl)-N-(2-fluorophenyl)propanamide is sourced from PubChem (CID 5305223), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).