(5S)-5-[[4-[[(5R)-2-oxo-1,3-oxazolidin-5-yl]methoxy]phenoxy]methyl]-1,3-oxazolidin-2-one

C14H16N2O6 — CID 950474

IUPAC(5S)-5-[[4-[[(5R)-2-oxo-1,3-oxazolidin-5-yl]methoxy]phenoxy]methyl]-1,3-oxazolidin-2-one
SMILESO=C1NC[C@H](COc2ccc(OC[C@@H]3CNC(=O)O3)cc2)O1
InChIInChI=1S/C14H16N2O6/c17-13-15-5-11(21-13)7-19-9-1-2-10(4-3-9)20-8-12-6-16-14(18)22-12/h1-4,11-12H,5-8H2,(H,15,17)(H,16,18)/t11-,12+
InChIKeyJXSJXWVGTDQKEF-TXEJJXNPSA-N
MW308.29 g/mol
LogP0.66
Rot. Bonds6

About (5S)-5-[[4-[[(5R)-2-oxo-1,3-oxazolidin-5-yl]methoxy]phenoxy]methyl]-1,3-oxazolidin-2-one

(5S)-5-[[4-[[(5R)-2-oxo-1,3-oxazolidin-5-yl]methoxy]phenoxy]methyl]-1,3-oxazolidin-2-one (PubChem CID 950474) has the molecular formula C14H16N2O6 and a molecular weight of 308.29 g/mol. Its IUPAC name is (5S)-5-[[4-[[(5R)-2-oxo-1,3-oxazolidin-5-yl]methoxy]phenoxy]methyl]-1,3-oxazolidin-2-one.

Molecular Properties

Compound Name(5S)-5-[[4-[[(5R)-2-oxo-1,3-oxazolidin-5-yl]methoxy]phenoxy]methyl]-1,3-oxazolidin-2-one
PubChem CID950474
Molecular FormulaC14H16N2O6
Molecular Weight308.29 g/mol
Exact Mass308.10
IUPAC Name(5S)-5-[[4-[[(5R)-2-oxo-1,3-oxazolidin-5-yl]methoxy]phenoxy]methyl]-1,3-oxazolidin-2-one
SMILESO=C1NC[C@H](COc2ccc(OC[C@@H]3CNC(=O)O3)cc2)O1
InChIInChI=1S/C14H16N2O6/c17-13-15-5-11(21-13)7-19-9-1-2-10(4-3-9)20-8-12-6-16-14(18)22-12/h1-4,11-12H,5-8H2,(H,15,17)(H,16,18)/t11-,12+
InChIKeyJXSJXWVGTDQKEF-TXEJJXNPSA-N
XLogP0.66
TPSA95.12 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500308.29
LogP ≤ 50.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze (5S)-5-[[4-[[(5R)-2-oxo-1,3-oxazolidin-5-yl]methoxy]phenoxy]methyl]-1,3-oxazolidin-2-one with MolForge

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Launch Full Analysis

Related Compounds

ethyl 4-[(2-oxo-1,3-oxazolidin-5-yl)methoxy]benzoate
CID 60673999
5-[[4-[2-(ethylamino)propyl]phenoxy]methyl]-1,3-oxazolidin-2-one
CID 115494942
2-fluoro-4-[(2-oxo-1,3-oxazolidin-5-yl)methoxy]benzoic acid
CID 107675374
2-methyl-4-[(2-oxo-1,3-oxazolidin-5-yl)methoxy]benzenesulfonamide
CID 82914735
5-[(1-hydroxy-2,3-dihydro-1H-inden-5-yl)oxymethyl]-1,3-oxazolidin-2-one
CID 107684721
CID 66849130
CID 66849130
(5S)-5-[(2-butoxyphenoxy)methyl]-1,3-oxazolidin-2-one
CID 95561590
5-[(2,6-dimethoxyphenoxy)methyl]-1,3-oxazolidin-2-one
CID 21423647
5-[[3-(methylaminomethyl)phenoxy]methyl]-1,3-oxazolidin-2-one
CID 60882601
(5R)-5-(naphthalen-1-yloxymethyl)-1,3-oxazolidin-2-one
CID 754370
(5S)-5-(methoxymethyl)-1,3-oxazolidin-2-one;sulfane
CID 157467427
5-[(6-amino-2,3-difluorophenoxy)methyl]-1,3-oxazolidin-2-one
CID 117095688

Frequently Asked Questions

What is the IUPAC name of (5S)-5-[[4-[[(5R)-2-oxo-1,3-oxazolidin-5-yl]methoxy]phenoxy]methyl]-1,3-oxazolidin-2-one?
The IUPAC name of (5S)-5-[[4-[[(5R)-2-oxo-1,3-oxazolidin-5-yl]methoxy]phenoxy]methyl]-1,3-oxazolidin-2-one (CID 950474) is (5S)-5-[[4-[[(5R)-2-oxo-1,3-oxazolidin-5-yl]methoxy]phenoxy]methyl]-1,3-oxazolidin-2-one.
What is the SMILES notation for (5S)-5-[[4-[[(5R)-2-oxo-1,3-oxazolidin-5-yl]methoxy]phenoxy]methyl]-1,3-oxazolidin-2-one?
The canonical SMILES for (5S)-5-[[4-[[(5R)-2-oxo-1,3-oxazolidin-5-yl]methoxy]phenoxy]methyl]-1,3-oxazolidin-2-one is O=C1NC[C@H](COc2ccc(OC[C@@H]3CNC(=O)O3)cc2)O1.
What is the InChIKey of (5S)-5-[[4-[[(5R)-2-oxo-1,3-oxazolidin-5-yl]methoxy]phenoxy]methyl]-1,3-oxazolidin-2-one?
The InChIKey is JXSJXWVGTDQKEF-TXEJJXNPSA-N. The full InChI is InChI=1S/C14H16N2O6/c17-13-15-5-11(21-13)7-19-9-1-2-10(4-3-9)20-8-12-6-16-14(18)22-12/h1-4,11-12H,5-8H2,(H,15,17)(H,16,18)/t11-,12+.
What are the key properties of (5S)-5-[[4-[[(5R)-2-oxo-1,3-oxazolidin-5-yl]methoxy]phenoxy]methyl]-1,3-oxazolidin-2-one?
(5S)-5-[[4-[[(5R)-2-oxo-1,3-oxazolidin-5-yl]methoxy]phenoxy]methyl]-1,3-oxazolidin-2-one has a molecular weight of 308.29 g/mol, XLogP of 0.66, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for (5S)-5-[[4-[[(5R)-2-oxo-1,3-oxazolidin-5-yl]methoxy]phenoxy]methyl]-1,3-oxazolidin-2-one is sourced from PubChem (CID 950474), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).