4-[(E)-2-(furan-2-yl)ethenyl]-4-methyl-1,3-oxazolidin-2-one

C10H11NO3 — CID 23031464

IUPAC4-[(E)-2-(furan-2-yl)ethenyl]-4-methyl-1,3-oxazolidin-2-one
SMILESCC1(/C=C/c2ccco2)COC(=O)N1
InChIInChI=1S/C10H11NO3/c1-10(7-14-9(12)11-10)5-4-8-3-2-6-13-8/h2-6H,7H2,1H3,(H,11,12)/b5-4+
InChIKeyMTCGCNZSHXTYLW-SNAWJCMRSA-N
MW193.20 g/mol
LogP1.79
Rot. Bonds2

About 4-[(E)-2-(furan-2-yl)ethenyl]-4-methyl-1,3-oxazolidin-2-one

4-[(E)-2-(furan-2-yl)ethenyl]-4-methyl-1,3-oxazolidin-2-one (PubChem CID 23031464) has the molecular formula C10H11NO3 and a molecular weight of 193.20 g/mol. Its IUPAC name is 4-[(E)-2-(furan-2-yl)ethenyl]-4-methyl-1,3-oxazolidin-2-one.

Molecular Properties

Compound Name4-[(E)-2-(furan-2-yl)ethenyl]-4-methyl-1,3-oxazolidin-2-one
PubChem CID23031464
Molecular FormulaC10H11NO3
Molecular Weight193.20 g/mol
Exact Mass193.07
IUPAC Name4-[(E)-2-(furan-2-yl)ethenyl]-4-methyl-1,3-oxazolidin-2-one
SMILESCC1(/C=C/c2ccco2)COC(=O)N1
InChIInChI=1S/C10H11NO3/c1-10(7-14-9(12)11-10)5-4-8-3-2-6-13-8/h2-6H,7H2,1H3,(H,11,12)/b5-4+
InChIKeyMTCGCNZSHXTYLW-SNAWJCMRSA-N
XLogP1.79
TPSA51.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.20
LogP ≤ 51.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-[(E)-2-(furan-2-yl)ethenyl]-4-methyl-1,3-oxazolidin-2-one?
The IUPAC name of 4-[(E)-2-(furan-2-yl)ethenyl]-4-methyl-1,3-oxazolidin-2-one (CID 23031464) is 4-[(E)-2-(furan-2-yl)ethenyl]-4-methyl-1,3-oxazolidin-2-one.
What is the SMILES notation for 4-[(E)-2-(furan-2-yl)ethenyl]-4-methyl-1,3-oxazolidin-2-one?
The canonical SMILES for 4-[(E)-2-(furan-2-yl)ethenyl]-4-methyl-1,3-oxazolidin-2-one is CC1(/C=C/c2ccco2)COC(=O)N1.
What is the InChIKey of 4-[(E)-2-(furan-2-yl)ethenyl]-4-methyl-1,3-oxazolidin-2-one?
The InChIKey is MTCGCNZSHXTYLW-SNAWJCMRSA-N. The full InChI is InChI=1S/C10H11NO3/c1-10(7-14-9(12)11-10)5-4-8-3-2-6-13-8/h2-6H,7H2,1H3,(H,11,12)/b5-4+.
What are the key properties of 4-[(E)-2-(furan-2-yl)ethenyl]-4-methyl-1,3-oxazolidin-2-one?
4-[(E)-2-(furan-2-yl)ethenyl]-4-methyl-1,3-oxazolidin-2-one has a molecular weight of 193.20 g/mol, XLogP of 1.79, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(E)-2-(furan-2-yl)ethenyl]-4-methyl-1,3-oxazolidin-2-one is sourced from PubChem (CID 23031464), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).