ethenamine;3-ethenyl-5-methyl-1,3-oxazolidin-2-one

C8H14N2O2 — CID 172711491

IUPACethenamine;3-ethenyl-5-methyl-1,3-oxazolidin-2-one
SMILESC=CN.C=CN1CC(C)OC1=O
InChIInChI=1S/C6H9NO2.C2H5N/c1-3-7-4-5(2)9-6(7)8;1-2-3/h3,5H,1,4H2,2H3;2H,1,3H2
InChIKeyFHRACKLWYCGAMS-UHFFFAOYSA-N
MW170.21 g/mol
LogP1.06
Rot. Bonds1

About ethenamine;3-ethenyl-5-methyl-1,3-oxazolidin-2-one

ethenamine;3-ethenyl-5-methyl-1,3-oxazolidin-2-one (PubChem CID 172711491) has the molecular formula C8H14N2O2 and a molecular weight of 170.21 g/mol. Its IUPAC name is ethenamine;3-ethenyl-5-methyl-1,3-oxazolidin-2-one.

Molecular Properties

Compound Nameethenamine;3-ethenyl-5-methyl-1,3-oxazolidin-2-one
PubChem CID172711491
Molecular FormulaC8H14N2O2
Molecular Weight170.21 g/mol
Exact Mass170.11
IUPAC Nameethenamine;3-ethenyl-5-methyl-1,3-oxazolidin-2-one
SMILESC=CN.C=CN1CC(C)OC1=O
InChIInChI=1S/C6H9NO2.C2H5N/c1-3-7-4-5(2)9-6(7)8;1-2-3/h3,5H,1,4H2,2H3;2H,1,3H2
InChIKeyFHRACKLWYCGAMS-UHFFFAOYSA-N
XLogP1.06
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.21
LogP ≤ 51.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-ethenyl-5-phenyl-1,3-oxazolidin-2-one
CID 21291189
(5S)-5-methyl-3-propan-2-yl-1,3-oxazolidin-2-one
CID 15320772
(5R)-5-methyl-3-propan-2-yl-1,3-oxazolidin-2-one
CID 142143749
(5R)-3-(4-aminophenyl)-5-methyl-1,3-oxazolidin-2-one
CID 59742698
(5S)-5-methyl-3-[4-(methyl-methylidene-oxo-λ6-sulfanyl)but-2-enyl]-1,3-oxazolidin-2-one
CID 59986951
(5S)-5-amino-3-methyl-1,3-oxazolidin-2-one
CID 154029551
5-methyl-3-pyrimidin-2-yl-1,3-oxazolidin-2-one
CID 141348613
(5S)-5-methyl-3-[5-(methyl-methylidene-oxo-λ6-sulfanyl)pent-3-enyl]-1,3-oxazolidin-2-one
CID 59986935
(5S)-3,5-dimethyl-1,3-oxazolidin-2-one;(5S)-3,5-dimethyloxolan-2-one;ethane
CID 157431674
5-methyl-3-(3-oxobutyl)-1,3-oxazolidin-2-one
CID 126971671
3-(4-hydroxyphenyl)-5-methyl-1,3-oxazolidin-2-one
CID 105446773
5-methyl-3-(4-sulfanylphenyl)-1,3-oxazolidin-2-one
CID 166026348

Frequently Asked Questions

What is the IUPAC name of ethenamine;3-ethenyl-5-methyl-1,3-oxazolidin-2-one?
The IUPAC name of ethenamine;3-ethenyl-5-methyl-1,3-oxazolidin-2-one (CID 172711491) is ethenamine;3-ethenyl-5-methyl-1,3-oxazolidin-2-one.
What is the SMILES notation for ethenamine;3-ethenyl-5-methyl-1,3-oxazolidin-2-one?
The canonical SMILES for ethenamine;3-ethenyl-5-methyl-1,3-oxazolidin-2-one is C=CN.C=CN1CC(C)OC1=O.
What is the InChIKey of ethenamine;3-ethenyl-5-methyl-1,3-oxazolidin-2-one?
The InChIKey is FHRACKLWYCGAMS-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9NO2.C2H5N/c1-3-7-4-5(2)9-6(7)8;1-2-3/h3,5H,1,4H2,2H3;2H,1,3H2.
What are the key properties of ethenamine;3-ethenyl-5-methyl-1,3-oxazolidin-2-one?
ethenamine;3-ethenyl-5-methyl-1,3-oxazolidin-2-one has a molecular weight of 170.21 g/mol, XLogP of 1.06, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethenamine;3-ethenyl-5-methyl-1,3-oxazolidin-2-one is sourced from PubChem (CID 172711491), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).