N-(4-fluorophenyl)-2-(4-hydroxy-4,5,5-trimethyl-2-oxo-1,3-oxazolidin-3-yl)acetamide

C14H17FN2O4 — CID 5236054

IUPACN-(4-fluorophenyl)-2-(4-hydroxy-4,5,5-trimethyl-2-oxo-1,3-oxazolidin-3-yl)acetamide
SMILESCC1(C)OC(=O)N(CC(=O)Nc2ccc(F)cc2)C1(C)O
InChIInChI=1S/C14H17FN2O4/c1-13(2)14(3,20)17(12(19)21-13)8-11(18)16-10-6-4-9(15)5-7-10/h4-7,20H,8H2,1-3H3,(H,16,18)
InChIKeyOSGSZGBFOWYWLK-UHFFFAOYSA-N
MW296.30 g/mol
LogP1.70
Rot. Bonds3

About N-(4-fluorophenyl)-2-(4-hydroxy-4,5,5-trimethyl-2-oxo-1,3-oxazolidin-3-yl)acetamide

N-(4-fluorophenyl)-2-(4-hydroxy-4,5,5-trimethyl-2-oxo-1,3-oxazolidin-3-yl)acetamide (PubChem CID 5236054) has the molecular formula C14H17FN2O4 and a molecular weight of 296.30 g/mol. Its IUPAC name is N-(4-fluorophenyl)-2-(4-hydroxy-4,5,5-trimethyl-2-oxo-1,3-oxazolidin-3-yl)acetamide.

Molecular Properties

Compound NameN-(4-fluorophenyl)-2-(4-hydroxy-4,5,5-trimethyl-2-oxo-1,3-oxazolidin-3-yl)acetamide
PubChem CID5236054
Molecular FormulaC14H17FN2O4
Molecular Weight296.30 g/mol
Exact Mass296.12
IUPAC NameN-(4-fluorophenyl)-2-(4-hydroxy-4,5,5-trimethyl-2-oxo-1,3-oxazolidin-3-yl)acetamide
SMILESCC1(C)OC(=O)N(CC(=O)Nc2ccc(F)cc2)C1(C)O
InChIInChI=1S/C14H17FN2O4/c1-13(2)14(3,20)17(12(19)21-13)8-11(18)16-10-6-4-9(15)5-7-10/h4-7,20H,8H2,1-3H3,(H,16,18)
InChIKeyOSGSZGBFOWYWLK-UHFFFAOYSA-N
XLogP1.70
TPSA78.87 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.30
LogP ≤ 51.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(4-fluorophenyl)-2-(4-hydroxy-4,5,5-trimethyl-2-oxo-1,3-oxazolidin-3-yl)acetamide?
The IUPAC name of N-(4-fluorophenyl)-2-(4-hydroxy-4,5,5-trimethyl-2-oxo-1,3-oxazolidin-3-yl)acetamide (CID 5236054) is N-(4-fluorophenyl)-2-(4-hydroxy-4,5,5-trimethyl-2-oxo-1,3-oxazolidin-3-yl)acetamide.
What is the SMILES notation for N-(4-fluorophenyl)-2-(4-hydroxy-4,5,5-trimethyl-2-oxo-1,3-oxazolidin-3-yl)acetamide?
The canonical SMILES for N-(4-fluorophenyl)-2-(4-hydroxy-4,5,5-trimethyl-2-oxo-1,3-oxazolidin-3-yl)acetamide is CC1(C)OC(=O)N(CC(=O)Nc2ccc(F)cc2)C1(C)O.
What is the InChIKey of N-(4-fluorophenyl)-2-(4-hydroxy-4,5,5-trimethyl-2-oxo-1,3-oxazolidin-3-yl)acetamide?
The InChIKey is OSGSZGBFOWYWLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17FN2O4/c1-13(2)14(3,20)17(12(19)21-13)8-11(18)16-10-6-4-9(15)5-7-10/h4-7,20H,8H2,1-3H3,(H,16,18).
What are the key properties of N-(4-fluorophenyl)-2-(4-hydroxy-4,5,5-trimethyl-2-oxo-1,3-oxazolidin-3-yl)acetamide?
N-(4-fluorophenyl)-2-(4-hydroxy-4,5,5-trimethyl-2-oxo-1,3-oxazolidin-3-yl)acetamide has a molecular weight of 296.30 g/mol, XLogP of 1.70, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-fluorophenyl)-2-(4-hydroxy-4,5,5-trimethyl-2-oxo-1,3-oxazolidin-3-yl)acetamide is sourced from PubChem (CID 5236054), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).