2-ethenyl-1,3-oxazol-4-ol

C5H5NO2 — CID 54314049

IUPAC2-ethenyl-1,3-oxazol-4-ol
SMILESC=Cc1nc(O)co1
InChIInChI=1S/C5H5NO2/c1-2-5-6-4(7)3-8-5/h2-3,7H,1H2
InChIKeySMXFQYMMKRPDQK-UHFFFAOYSA-N
MW111.10 g/mol
LogP1.02
Rot. Bonds1

About 2-ethenyl-1,3-oxazol-4-ol

2-ethenyl-1,3-oxazol-4-ol (PubChem CID 54314049) has the molecular formula C5H5NO2 and a molecular weight of 111.10 g/mol. Its IUPAC name is 2-ethenyl-1,3-oxazol-4-ol.

Molecular Properties

Compound Name2-ethenyl-1,3-oxazol-4-ol
PubChem CID54314049
Molecular FormulaC5H5NO2
Molecular Weight111.10 g/mol
Exact Mass111.03
IUPAC Name2-ethenyl-1,3-oxazol-4-ol
SMILESC=Cc1nc(O)co1
InChIInChI=1S/C5H5NO2/c1-2-5-6-4(7)3-8-5/h2-3,7H,1H2
InChIKeySMXFQYMMKRPDQK-UHFFFAOYSA-N
XLogP1.02
TPSA46.26 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500111.10
LogP ≤ 51.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-ethenyl-1,3-oxazol-4-ol?
The IUPAC name of 2-ethenyl-1,3-oxazol-4-ol (CID 54314049) is 2-ethenyl-1,3-oxazol-4-ol.
What is the SMILES notation for 2-ethenyl-1,3-oxazol-4-ol?
The canonical SMILES for 2-ethenyl-1,3-oxazol-4-ol is C=Cc1nc(O)co1.
What is the InChIKey of 2-ethenyl-1,3-oxazol-4-ol?
The InChIKey is SMXFQYMMKRPDQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H5NO2/c1-2-5-6-4(7)3-8-5/h2-3,7H,1H2.
What are the key properties of 2-ethenyl-1,3-oxazol-4-ol?
2-ethenyl-1,3-oxazol-4-ol has a molecular weight of 111.10 g/mol, XLogP of 1.02, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethenyl-1,3-oxazol-4-ol is sourced from PubChem (CID 54314049), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).