2-[5-(3-hydroxyphenyl)-2-oxo-1,3-oxazolidin-3-yl]acetic acid

C11H11NO5 — CID 83850912

IUPAC2-[5-(3-hydroxyphenyl)-2-oxo-1,3-oxazolidin-3-yl]acetic acid
SMILESO=C(O)CN1CC(c2cccc(O)c2)OC1=O
InChIInChI=1S/C11H11NO5/c13-8-3-1-2-7(4-8)9-5-12(6-10(14)15)11(16)17-9/h1-4,9,13H,5-6H2,(H,14,15)
InChIKeyIGQBONGKMLDRGW-UHFFFAOYSA-N
MW237.21 g/mol
LogP0.97
Rot. Bonds3

About 2-[5-(3-hydroxyphenyl)-2-oxo-1,3-oxazolidin-3-yl]acetic acid

2-[5-(3-hydroxyphenyl)-2-oxo-1,3-oxazolidin-3-yl]acetic acid (PubChem CID 83850912) has the molecular formula C11H11NO5 and a molecular weight of 237.21 g/mol. Its IUPAC name is 2-[5-(3-hydroxyphenyl)-2-oxo-1,3-oxazolidin-3-yl]acetic acid.

Molecular Properties

Compound Name2-[5-(3-hydroxyphenyl)-2-oxo-1,3-oxazolidin-3-yl]acetic acid
PubChem CID83850912
Molecular FormulaC11H11NO5
Molecular Weight237.21 g/mol
Exact Mass237.06
IUPAC Name2-[5-(3-hydroxyphenyl)-2-oxo-1,3-oxazolidin-3-yl]acetic acid
SMILESO=C(O)CN1CC(c2cccc(O)c2)OC1=O
InChIInChI=1S/C11H11NO5/c13-8-3-1-2-7(4-8)9-5-12(6-10(14)15)11(16)17-9/h1-4,9,13H,5-6H2,(H,14,15)
InChIKeyIGQBONGKMLDRGW-UHFFFAOYSA-N
XLogP0.97
TPSA87.07 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.21
LogP ≤ 50.97
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[5-(4-ethylphenyl)-2-oxo-1,3-oxazolidin-3-yl]acetic acid
CID 82087088
(5R)-5-(3-chlorophenyl)-3-ethyl-1,3-oxazolidin-2-one
CID 70899680
5-(3-bromophenyl)-3-ethyl-1,3-oxazolidin-2-one
CID 83903279
3-(oxiran-2-yl)phenol;phenol
CID 87353327
2-(5-ethyl-2-oxo-1,3-oxazolidin-3-yl)acetic acid
CID 23551399
2-[(5S)-5-(3-hydroxyphenyl)-3-methyl-1,3-oxazolidin-2-ylidene]indene-1,3-dione
CID 124851035
2-(6-tert-butyl-2-phenyl-2,3-dihydro-1,4-benzoxazin-4-yl)acetic acid
CID 82142560
2-[(5R)-5-(3-hydroxyphenyl)-3-methyl-1,3-oxazolidin-2-ylidene]indene-1,3-dione
CID 124851034
3-(2-aminoethyl)-5-(3-chlorophenyl)-1,3-oxazolidin-2-one
CID 82084550
3-(2-chloroethyl)-5-(3-methylphenyl)-1,3-oxazolidin-2-one
CID 82084411
(5R)-3-(4-hydroxyphenyl)-5-phenyl-1,3-oxazolidin-2-one
CID 54314065
3-acetyl-5-phenyl-1,3-oxazolidin-2-one
CID 101053098

Frequently Asked Questions

What is the IUPAC name of 2-[5-(3-hydroxyphenyl)-2-oxo-1,3-oxazolidin-3-yl]acetic acid?
The IUPAC name of 2-[5-(3-hydroxyphenyl)-2-oxo-1,3-oxazolidin-3-yl]acetic acid (CID 83850912) is 2-[5-(3-hydroxyphenyl)-2-oxo-1,3-oxazolidin-3-yl]acetic acid.
What is the SMILES notation for 2-[5-(3-hydroxyphenyl)-2-oxo-1,3-oxazolidin-3-yl]acetic acid?
The canonical SMILES for 2-[5-(3-hydroxyphenyl)-2-oxo-1,3-oxazolidin-3-yl]acetic acid is O=C(O)CN1CC(c2cccc(O)c2)OC1=O.
What is the InChIKey of 2-[5-(3-hydroxyphenyl)-2-oxo-1,3-oxazolidin-3-yl]acetic acid?
The InChIKey is IGQBONGKMLDRGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11NO5/c13-8-3-1-2-7(4-8)9-5-12(6-10(14)15)11(16)17-9/h1-4,9,13H,5-6H2,(H,14,15).
What are the key properties of 2-[5-(3-hydroxyphenyl)-2-oxo-1,3-oxazolidin-3-yl]acetic acid?
2-[5-(3-hydroxyphenyl)-2-oxo-1,3-oxazolidin-3-yl]acetic acid has a molecular weight of 237.21 g/mol, XLogP of 0.97, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[5-(3-hydroxyphenyl)-2-oxo-1,3-oxazolidin-3-yl]acetic acid is sourced from PubChem (CID 83850912), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).