2-[3-(3-fluoromorpholin-4-yl)-2-oxo-4-phenyl-1,3-oxazolidin-5-yl]propanamide

C16H20FN3O4 — CID 174638513

IUPAC2-[3-(3-fluoromorpholin-4-yl)-2-oxo-4-phenyl-1,3-oxazolidin-5-yl]propanamide
SMILESCC(C(N)=O)C1OC(=O)N(N2CCOCC2F)C1c1ccccc1
InChIInChI=1S/C16H20FN3O4/c1-10(15(18)21)14-13(11-5-3-2-4-6-11)20(16(22)24-14)19-7-8-23-9-12(19)17/h2-6,10,12-14H,7-9H2,1H3,(H2,18,21)
InChIKeyLDUGYBYIXPZJBC-UHFFFAOYSA-N
MW337.35 g/mol
LogP1.21
Rot. Bonds4

About 2-[3-(3-fluoromorpholin-4-yl)-2-oxo-4-phenyl-1,3-oxazolidin-5-yl]propanamide

2-[3-(3-fluoromorpholin-4-yl)-2-oxo-4-phenyl-1,3-oxazolidin-5-yl]propanamide (PubChem CID 174638513) has the molecular formula C16H20FN3O4 and a molecular weight of 337.35 g/mol. Its IUPAC name is 2-[3-(3-fluoromorpholin-4-yl)-2-oxo-4-phenyl-1,3-oxazolidin-5-yl]propanamide.

Molecular Properties

Compound Name2-[3-(3-fluoromorpholin-4-yl)-2-oxo-4-phenyl-1,3-oxazolidin-5-yl]propanamide
PubChem CID174638513
Molecular FormulaC16H20FN3O4
Molecular Weight337.35 g/mol
Exact Mass337.14
IUPAC Name2-[3-(3-fluoromorpholin-4-yl)-2-oxo-4-phenyl-1,3-oxazolidin-5-yl]propanamide
SMILESCC(C(N)=O)C1OC(=O)N(N2CCOCC2F)C1c1ccccc1
InChIInChI=1S/C16H20FN3O4/c1-10(15(18)21)14-13(11-5-3-2-4-6-11)20(16(22)24-14)19-7-8-23-9-12(19)17/h2-6,10,12-14H,7-9H2,1H3,(H2,18,21)
InChIKeyLDUGYBYIXPZJBC-UHFFFAOYSA-N
XLogP1.21
TPSA85.10 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.35
LogP ≤ 51.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'N-C-halo', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-[3-(3-fluoromorpholin-4-yl)-2-oxo-4-phenyl-1,3-oxazolidin-5-yl]propanamide?
The IUPAC name of 2-[3-(3-fluoromorpholin-4-yl)-2-oxo-4-phenyl-1,3-oxazolidin-5-yl]propanamide (CID 174638513) is 2-[3-(3-fluoromorpholin-4-yl)-2-oxo-4-phenyl-1,3-oxazolidin-5-yl]propanamide.
What is the SMILES notation for 2-[3-(3-fluoromorpholin-4-yl)-2-oxo-4-phenyl-1,3-oxazolidin-5-yl]propanamide?
The canonical SMILES for 2-[3-(3-fluoromorpholin-4-yl)-2-oxo-4-phenyl-1,3-oxazolidin-5-yl]propanamide is CC(C(N)=O)C1OC(=O)N(N2CCOCC2F)C1c1ccccc1.
What is the InChIKey of 2-[3-(3-fluoromorpholin-4-yl)-2-oxo-4-phenyl-1,3-oxazolidin-5-yl]propanamide?
The InChIKey is LDUGYBYIXPZJBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20FN3O4/c1-10(15(18)21)14-13(11-5-3-2-4-6-11)20(16(22)24-14)19-7-8-23-9-12(19)17/h2-6,10,12-14H,7-9H2,1H3,(H2,18,21).
What are the key properties of 2-[3-(3-fluoromorpholin-4-yl)-2-oxo-4-phenyl-1,3-oxazolidin-5-yl]propanamide?
2-[3-(3-fluoromorpholin-4-yl)-2-oxo-4-phenyl-1,3-oxazolidin-5-yl]propanamide has a molecular weight of 337.35 g/mol, XLogP of 1.21, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(3-fluoromorpholin-4-yl)-2-oxo-4-phenyl-1,3-oxazolidin-5-yl]propanamide is sourced from PubChem (CID 174638513), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).