ethyl 4-[[2-(2-oxo-1,3-oxazolidin-3-yl)acetyl]amino]benzoate

C14H16N2O5 — CID 110686650

IUPACethyl 4-[[2-(2-oxo-1,3-oxazolidin-3-yl)acetyl]amino]benzoate
SMILESCCOC(=O)c1ccc(NC(=O)CN2CCOC2=O)cc1
InChIInChI=1S/C14H16N2O5/c1-2-20-13(18)10-3-5-11(6-4-10)15-12(17)9-16-7-8-21-14(16)19/h3-6H,2,7-9H2,1H3,(H,15,17)
InChIKeyUTEWHHKGRDLWKG-UHFFFAOYSA-N
MW292.29 g/mol
LogP1.25
Rot. Bonds5

About ethyl 4-[[2-(2-oxo-1,3-oxazolidin-3-yl)acetyl]amino]benzoate

ethyl 4-[[2-(2-oxo-1,3-oxazolidin-3-yl)acetyl]amino]benzoate (PubChem CID 110686650) has the molecular formula C14H16N2O5 and a molecular weight of 292.29 g/mol. Its IUPAC name is ethyl 4-[[2-(2-oxo-1,3-oxazolidin-3-yl)acetyl]amino]benzoate.

Molecular Properties

Compound Nameethyl 4-[[2-(2-oxo-1,3-oxazolidin-3-yl)acetyl]amino]benzoate
PubChem CID110686650
Molecular FormulaC14H16N2O5
Molecular Weight292.29 g/mol
Exact Mass292.11
IUPAC Nameethyl 4-[[2-(2-oxo-1,3-oxazolidin-3-yl)acetyl]amino]benzoate
SMILESCCOC(=O)c1ccc(NC(=O)CN2CCOC2=O)cc1
InChIInChI=1S/C14H16N2O5/c1-2-20-13(18)10-3-5-11(6-4-10)15-12(17)9-16-7-8-21-14(16)19/h3-6H,2,7-9H2,1H3,(H,15,17)
InChIKeyUTEWHHKGRDLWKG-UHFFFAOYSA-N
XLogP1.25
TPSA84.94 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.29
LogP ≤ 51.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze ethyl 4-[[2-(2-oxo-1,3-oxazolidin-3-yl)acetyl]amino]benzoate with MolForge

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of ethyl 4-[[2-(2-oxo-1,3-oxazolidin-3-yl)acetyl]amino]benzoate?
The IUPAC name of ethyl 4-[[2-(2-oxo-1,3-oxazolidin-3-yl)acetyl]amino]benzoate (CID 110686650) is ethyl 4-[[2-(2-oxo-1,3-oxazolidin-3-yl)acetyl]amino]benzoate.
What is the SMILES notation for ethyl 4-[[2-(2-oxo-1,3-oxazolidin-3-yl)acetyl]amino]benzoate?
The canonical SMILES for ethyl 4-[[2-(2-oxo-1,3-oxazolidin-3-yl)acetyl]amino]benzoate is CCOC(=O)c1ccc(NC(=O)CN2CCOC2=O)cc1.
What is the InChIKey of ethyl 4-[[2-(2-oxo-1,3-oxazolidin-3-yl)acetyl]amino]benzoate?
The InChIKey is UTEWHHKGRDLWKG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O5/c1-2-20-13(18)10-3-5-11(6-4-10)15-12(17)9-16-7-8-21-14(16)19/h3-6H,2,7-9H2,1H3,(H,15,17).
What are the key properties of ethyl 4-[[2-(2-oxo-1,3-oxazolidin-3-yl)acetyl]amino]benzoate?
ethyl 4-[[2-(2-oxo-1,3-oxazolidin-3-yl)acetyl]amino]benzoate has a molecular weight of 292.29 g/mol, XLogP of 1.25, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl 4-[[2-(2-oxo-1,3-oxazolidin-3-yl)acetyl]amino]benzoate is sourced from PubChem (CID 110686650), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).