N-[[3-(3-fluoro-4-morpholin-2-ylphenyl)-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide

C16H20FN3O4 — CID 21145174

IUPACN-[[3-(3-fluoro-4-morpholin-2-ylphenyl)-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide
SMILESCC(=O)NCC1CN(c2ccc(C3CNCCO3)c(F)c2)C(=O)O1
InChIInChI=1S/C16H20FN3O4/c1-10(21)19-7-12-9-20(16(22)24-12)11-2-3-13(14(17)6-11)15-8-18-4-5-23-15/h2-3,6,12,15,18H,4-5,7-9H2,1H3,(H,19,21)
InChIKeyYTDXEJVWGQFNQO-UHFFFAOYSA-N
MW337.35 g/mol
LogP0.95
Rot. Bonds4

About N-[[3-(3-fluoro-4-morpholin-2-ylphenyl)-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide

N-[[3-(3-fluoro-4-morpholin-2-ylphenyl)-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide (PubChem CID 21145174) has the molecular formula C16H20FN3O4 and a molecular weight of 337.35 g/mol. Its IUPAC name is N-[[3-(3-fluoro-4-morpholin-2-ylphenyl)-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide.

Molecular Properties

Compound NameN-[[3-(3-fluoro-4-morpholin-2-ylphenyl)-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide
PubChem CID21145174
Molecular FormulaC16H20FN3O4
Molecular Weight337.35 g/mol
Exact Mass337.14
IUPAC NameN-[[3-(3-fluoro-4-morpholin-2-ylphenyl)-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide
SMILESCC(=O)NCC1CN(c2ccc(C3CNCCO3)c(F)c2)C(=O)O1
InChIInChI=1S/C16H20FN3O4/c1-10(21)19-7-12-9-20(16(22)24-12)11-2-3-13(14(17)6-11)15-8-18-4-5-23-15/h2-3,6,12,15,18H,4-5,7-9H2,1H3,(H,19,21)
InChIKeyYTDXEJVWGQFNQO-UHFFFAOYSA-N
XLogP0.95
TPSA79.90 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.35
LogP ≤ 50.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze N-[[3-(3-fluoro-4-morpholin-2-ylphenyl)-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide with MolForge

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Related Compounds

N-[[(5S)-3-[3-fluoro-4-[4-(hydroxymethyl)phenyl]phenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide
CID 60045898
5-(2-fluorophenyl)-3-(2,3,4,5-tetrahydro-1H-3-benzazepin-7-yl)-1,3-oxazolidin-2-one
CID 90656167
tert-butyl 4-(6-morpholino-4-oxo-4H-pyran-2-yl)phenylcarbamate
CID 16203357
N-[[(5S)-3-[3-fluoro-4-[3-(hydroxymethyl)phenyl]phenyl]-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide
CID 57545489
N-[3-(2-Fluoro-4'-hydroxymethyl-biphenyl-4-yl)-2-oxo-oxazolidin-5-ylmethyl]-acetamide
CID 21907449
N-[(4-fluorophenyl)methyl]-4-[(2S)-morpholin-2-yl]aniline
CID 68325418
US9790230, Example 70
CID 118695965
US9790230, Example 84
CID 118700351
US9790230, Example 90
CID 118700410
US9790230, Example 91
CID 118859484
US9790230, Example 73
CID 129115583
US9790230, Example 66
CID 129115617

Frequently Asked Questions

What is the IUPAC name of N-[[3-(3-fluoro-4-morpholin-2-ylphenyl)-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide?
The IUPAC name of N-[[3-(3-fluoro-4-morpholin-2-ylphenyl)-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide (CID 21145174) is N-[[3-(3-fluoro-4-morpholin-2-ylphenyl)-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide.
What is the SMILES notation for N-[[3-(3-fluoro-4-morpholin-2-ylphenyl)-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide?
The canonical SMILES for N-[[3-(3-fluoro-4-morpholin-2-ylphenyl)-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide is CC(=O)NCC1CN(c2ccc(C3CNCCO3)c(F)c2)C(=O)O1.
What is the InChIKey of N-[[3-(3-fluoro-4-morpholin-2-ylphenyl)-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide?
The InChIKey is YTDXEJVWGQFNQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20FN3O4/c1-10(21)19-7-12-9-20(16(22)24-12)11-2-3-13(14(17)6-11)15-8-18-4-5-23-15/h2-3,6,12,15,18H,4-5,7-9H2,1H3,(H,19,21).
What are the key properties of N-[[3-(3-fluoro-4-morpholin-2-ylphenyl)-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide?
N-[[3-(3-fluoro-4-morpholin-2-ylphenyl)-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide has a molecular weight of 337.35 g/mol, XLogP of 0.95, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[3-(3-fluoro-4-morpholin-2-ylphenyl)-2-oxo-1,3-oxazolidin-5-yl]methyl]acetamide is sourced from PubChem (CID 21145174), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).