2-(2-hydroxyethyl)-5-propan-2-yl-1,2-oxazolidin-3-one

C8H15NO3 — CID 105435468

IUPAC2-(2-hydroxyethyl)-5-propan-2-yl-1,2-oxazolidin-3-one
SMILESCC(C)C1CC(=O)N(CCO)O1
InChIInChI=1S/C8H15NO3/c1-6(2)7-5-8(11)9(12-7)3-4-10/h6-7,10H,3-5H2,1-2H3
InChIKeyGOOMJZSLXNQYHZ-UHFFFAOYSA-N
MW173.21 g/mol
LogP0.17
Rot. Bonds3

About 2-(2-hydroxyethyl)-5-propan-2-yl-1,2-oxazolidin-3-one

2-(2-hydroxyethyl)-5-propan-2-yl-1,2-oxazolidin-3-one (PubChem CID 105435468) has the molecular formula C8H15NO3 and a molecular weight of 173.21 g/mol. Its IUPAC name is 2-(2-hydroxyethyl)-5-propan-2-yl-1,2-oxazolidin-3-one.

Molecular Properties

Compound Name2-(2-hydroxyethyl)-5-propan-2-yl-1,2-oxazolidin-3-one
PubChem CID105435468
Molecular FormulaC8H15NO3
Molecular Weight173.21 g/mol
Exact Mass173.11
IUPAC Name2-(2-hydroxyethyl)-5-propan-2-yl-1,2-oxazolidin-3-one
SMILESCC(C)C1CC(=O)N(CCO)O1
InChIInChI=1S/C8H15NO3/c1-6(2)7-5-8(11)9(12-7)3-4-10/h6-7,10H,3-5H2,1-2H3
InChIKeyGOOMJZSLXNQYHZ-UHFFFAOYSA-N
XLogP0.17
TPSA49.77 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.21
LogP ≤ 50.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(2-hydroxyethyl)-5-propan-2-yl-1,2-oxazolidin-3-one?
The IUPAC name of 2-(2-hydroxyethyl)-5-propan-2-yl-1,2-oxazolidin-3-one (CID 105435468) is 2-(2-hydroxyethyl)-5-propan-2-yl-1,2-oxazolidin-3-one.
What is the SMILES notation for 2-(2-hydroxyethyl)-5-propan-2-yl-1,2-oxazolidin-3-one?
The canonical SMILES for 2-(2-hydroxyethyl)-5-propan-2-yl-1,2-oxazolidin-3-one is CC(C)C1CC(=O)N(CCO)O1.
What is the InChIKey of 2-(2-hydroxyethyl)-5-propan-2-yl-1,2-oxazolidin-3-one?
The InChIKey is GOOMJZSLXNQYHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15NO3/c1-6(2)7-5-8(11)9(12-7)3-4-10/h6-7,10H,3-5H2,1-2H3.
What are the key properties of 2-(2-hydroxyethyl)-5-propan-2-yl-1,2-oxazolidin-3-one?
2-(2-hydroxyethyl)-5-propan-2-yl-1,2-oxazolidin-3-one has a molecular weight of 173.21 g/mol, XLogP of 0.17, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-hydroxyethyl)-5-propan-2-yl-1,2-oxazolidin-3-one is sourced from PubChem (CID 105435468), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).