3-[4-(2-hydroxyethyl)phenyl]-1,3-oxazolidin-2-one

C11H13NO3 — CID 23020757

IUPAC3-[4-(2-hydroxyethyl)phenyl]-1,3-oxazolidin-2-one
SMILESO=C1OCCN1c1ccc(CCO)cc1
InChIInChI=1S/C11H13NO3/c13-7-5-9-1-3-10(4-2-9)12-6-8-15-11(12)14/h1-4,13H,5-8H2
InChIKeyMPHLAWJUFUFZFR-UHFFFAOYSA-N
MW207.23 g/mol
LogP1.18
Rot. Bonds3

About 3-[4-(2-hydroxyethyl)phenyl]-1,3-oxazolidin-2-one

3-[4-(2-hydroxyethyl)phenyl]-1,3-oxazolidin-2-one (PubChem CID 23020757) has the molecular formula C11H13NO3 and a molecular weight of 207.23 g/mol. Its IUPAC name is 3-[4-(2-hydroxyethyl)phenyl]-1,3-oxazolidin-2-one.

Molecular Properties

Compound Name3-[4-(2-hydroxyethyl)phenyl]-1,3-oxazolidin-2-one
PubChem CID23020757
Molecular FormulaC11H13NO3
Molecular Weight207.23 g/mol
Exact Mass207.09
IUPAC Name3-[4-(2-hydroxyethyl)phenyl]-1,3-oxazolidin-2-one
SMILESO=C1OCCN1c1ccc(CCO)cc1
InChIInChI=1S/C11H13NO3/c13-7-5-9-1-3-10(4-2-9)12-6-8-15-11(12)14/h1-4,13H,5-8H2
InChIKeyMPHLAWJUFUFZFR-UHFFFAOYSA-N
XLogP1.18
TPSA49.77 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.23
LogP ≤ 51.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-[4-(2-hydroxyethyl)phenyl]-1,3-oxazolidin-2-one?
The IUPAC name of 3-[4-(2-hydroxyethyl)phenyl]-1,3-oxazolidin-2-one (CID 23020757) is 3-[4-(2-hydroxyethyl)phenyl]-1,3-oxazolidin-2-one.
What is the SMILES notation for 3-[4-(2-hydroxyethyl)phenyl]-1,3-oxazolidin-2-one?
The canonical SMILES for 3-[4-(2-hydroxyethyl)phenyl]-1,3-oxazolidin-2-one is O=C1OCCN1c1ccc(CCO)cc1.
What is the InChIKey of 3-[4-(2-hydroxyethyl)phenyl]-1,3-oxazolidin-2-one?
The InChIKey is MPHLAWJUFUFZFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13NO3/c13-7-5-9-1-3-10(4-2-9)12-6-8-15-11(12)14/h1-4,13H,5-8H2.
What are the key properties of 3-[4-(2-hydroxyethyl)phenyl]-1,3-oxazolidin-2-one?
3-[4-(2-hydroxyethyl)phenyl]-1,3-oxazolidin-2-one has a molecular weight of 207.23 g/mol, XLogP of 1.18, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[4-(2-hydroxyethyl)phenyl]-1,3-oxazolidin-2-one is sourced from PubChem (CID 23020757), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).