5-cyclobutyl-2-(3-hydroxypropyl)-5-methyl-1,2-oxazolidin-3-one

C11H19NO3 — CID 105466800

IUPAC5-cyclobutyl-2-(3-hydroxypropyl)-5-methyl-1,2-oxazolidin-3-one
SMILESCC1(C2CCC2)CC(=O)N(CCCO)O1
InChIInChI=1S/C11H19NO3/c1-11(9-4-2-5-9)8-10(14)12(15-11)6-3-7-13/h9,13H,2-8H2,1H3
InChIKeyJXBIKKYRYMLAFW-UHFFFAOYSA-N
MW213.28 g/mol
LogP1.09
Rot. Bonds4

About 5-cyclobutyl-2-(3-hydroxypropyl)-5-methyl-1,2-oxazolidin-3-one

5-cyclobutyl-2-(3-hydroxypropyl)-5-methyl-1,2-oxazolidin-3-one (PubChem CID 105466800) has the molecular formula C11H19NO3 and a molecular weight of 213.28 g/mol. Its IUPAC name is 5-cyclobutyl-2-(3-hydroxypropyl)-5-methyl-1,2-oxazolidin-3-one.

Molecular Properties

Compound Name5-cyclobutyl-2-(3-hydroxypropyl)-5-methyl-1,2-oxazolidin-3-one
PubChem CID105466800
Molecular FormulaC11H19NO3
Molecular Weight213.28 g/mol
Exact Mass213.14
IUPAC Name5-cyclobutyl-2-(3-hydroxypropyl)-5-methyl-1,2-oxazolidin-3-one
SMILESCC1(C2CCC2)CC(=O)N(CCCO)O1
InChIInChI=1S/C11H19NO3/c1-11(9-4-2-5-9)8-10(14)12(15-11)6-3-7-13/h9,13H,2-8H2,1H3
InChIKeyJXBIKKYRYMLAFW-UHFFFAOYSA-N
XLogP1.09
TPSA49.77 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.28
LogP ≤ 51.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-cyclobutyl-2-(3-hydroxypropyl)-5-methyl-1,2-oxazolidin-3-one?
The IUPAC name of 5-cyclobutyl-2-(3-hydroxypropyl)-5-methyl-1,2-oxazolidin-3-one (CID 105466800) is 5-cyclobutyl-2-(3-hydroxypropyl)-5-methyl-1,2-oxazolidin-3-one.
What is the SMILES notation for 5-cyclobutyl-2-(3-hydroxypropyl)-5-methyl-1,2-oxazolidin-3-one?
The canonical SMILES for 5-cyclobutyl-2-(3-hydroxypropyl)-5-methyl-1,2-oxazolidin-3-one is CC1(C2CCC2)CC(=O)N(CCCO)O1.
What is the InChIKey of 5-cyclobutyl-2-(3-hydroxypropyl)-5-methyl-1,2-oxazolidin-3-one?
The InChIKey is JXBIKKYRYMLAFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19NO3/c1-11(9-4-2-5-9)8-10(14)12(15-11)6-3-7-13/h9,13H,2-8H2,1H3.
What are the key properties of 5-cyclobutyl-2-(3-hydroxypropyl)-5-methyl-1,2-oxazolidin-3-one?
5-cyclobutyl-2-(3-hydroxypropyl)-5-methyl-1,2-oxazolidin-3-one has a molecular weight of 213.28 g/mol, XLogP of 1.09, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclobutyl-2-(3-hydroxypropyl)-5-methyl-1,2-oxazolidin-3-one is sourced from PubChem (CID 105466800), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).