4-hydroxy-1,4-oxazine

C4H5NO2 — CID 70080168

IUPAC4-hydroxy-1,4-oxazine
SMILESON1C=COC=C1
InChIInChI=1S/C4H5NO2/c6-5-1-3-7-4-2-5/h1-4,6H
InChIKeySSHZBRYRHTUODU-UHFFFAOYSA-N
MW99.09 g/mol
LogP0.65
Rot. Bonds

About 4-hydroxy-1,4-oxazine

4-hydroxy-1,4-oxazine (PubChem CID 70080168) has the molecular formula C4H5NO2 and a molecular weight of 99.09 g/mol. Its IUPAC name is 4-hydroxy-1,4-oxazine.

Molecular Properties

Compound Name4-hydroxy-1,4-oxazine
PubChem CID70080168
Molecular FormulaC4H5NO2
Molecular Weight99.09 g/mol
Exact Mass99.03
IUPAC Name4-hydroxy-1,4-oxazine
SMILESON1C=COC=C1
InChIInChI=1S/C4H5NO2/c6-5-1-3-7-4-2-5/h1-4,6H
InChIKeySSHZBRYRHTUODU-UHFFFAOYSA-N
XLogP0.65
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50099.09
LogP ≤ 50.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-1,4-oxazine?
The IUPAC name of 4-hydroxy-1,4-oxazine (CID 70080168) is 4-hydroxy-1,4-oxazine.
What is the SMILES notation for 4-hydroxy-1,4-oxazine?
The canonical SMILES for 4-hydroxy-1,4-oxazine is ON1C=COC=C1.
What is the InChIKey of 4-hydroxy-1,4-oxazine?
The InChIKey is SSHZBRYRHTUODU-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H5NO2/c6-5-1-3-7-4-2-5/h1-4,6H.
What are the key properties of 4-hydroxy-1,4-oxazine?
4-hydroxy-1,4-oxazine has a molecular weight of 99.09 g/mol, XLogP of 0.65, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-1,4-oxazine is sourced from PubChem (CID 70080168), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).