3-ethyl-5-methyl-5-pyrrolidin-3-yl-1,3-oxazolidin-2-one

C10H18N2O2 — CID 115065098

IUPAC3-ethyl-5-methyl-5-pyrrolidin-3-yl-1,3-oxazolidin-2-one
SMILESCCN1CC(C)(C2CCNC2)OC1=O
InChIInChI=1S/C10H18N2O2/c1-3-12-7-10(2,14-9(12)13)8-4-5-11-6-8/h8,11H,3-7H2,1-2H3
InChIKeyGWHBCEOHPRODCE-UHFFFAOYSA-N
MW198.27 g/mol
LogP0.83
Rot. Bonds2

About 3-ethyl-5-methyl-5-pyrrolidin-3-yl-1,3-oxazolidin-2-one

3-ethyl-5-methyl-5-pyrrolidin-3-yl-1,3-oxazolidin-2-one (PubChem CID 115065098) has the molecular formula C10H18N2O2 and a molecular weight of 198.27 g/mol. Its IUPAC name is 3-ethyl-5-methyl-5-pyrrolidin-3-yl-1,3-oxazolidin-2-one.

Molecular Properties

Compound Name3-ethyl-5-methyl-5-pyrrolidin-3-yl-1,3-oxazolidin-2-one
PubChem CID115065098
Molecular FormulaC10H18N2O2
Molecular Weight198.27 g/mol
Exact Mass198.14
IUPAC Name3-ethyl-5-methyl-5-pyrrolidin-3-yl-1,3-oxazolidin-2-one
SMILESCCN1CC(C)(C2CCNC2)OC1=O
InChIInChI=1S/C10H18N2O2/c1-3-12-7-10(2,14-9(12)13)8-4-5-11-6-8/h8,11H,3-7H2,1-2H3
InChIKeyGWHBCEOHPRODCE-UHFFFAOYSA-N
XLogP0.83
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.27
LogP ≤ 50.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-ethyl-5-methyl-5-pyrrolidin-3-yl-1,3-oxazolidin-2-one?
The IUPAC name of 3-ethyl-5-methyl-5-pyrrolidin-3-yl-1,3-oxazolidin-2-one (CID 115065098) is 3-ethyl-5-methyl-5-pyrrolidin-3-yl-1,3-oxazolidin-2-one.
What is the SMILES notation for 3-ethyl-5-methyl-5-pyrrolidin-3-yl-1,3-oxazolidin-2-one?
The canonical SMILES for 3-ethyl-5-methyl-5-pyrrolidin-3-yl-1,3-oxazolidin-2-one is CCN1CC(C)(C2CCNC2)OC1=O.
What is the InChIKey of 3-ethyl-5-methyl-5-pyrrolidin-3-yl-1,3-oxazolidin-2-one?
The InChIKey is GWHBCEOHPRODCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O2/c1-3-12-7-10(2,14-9(12)13)8-4-5-11-6-8/h8,11H,3-7H2,1-2H3.
What are the key properties of 3-ethyl-5-methyl-5-pyrrolidin-3-yl-1,3-oxazolidin-2-one?
3-ethyl-5-methyl-5-pyrrolidin-3-yl-1,3-oxazolidin-2-one has a molecular weight of 198.27 g/mol, XLogP of 0.83, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-5-methyl-5-pyrrolidin-3-yl-1,3-oxazolidin-2-one is sourced from PubChem (CID 115065098), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).