[5-(ethoxymethyl)-1,3-oxazol-4-yl]methanol

C7H11NO3 — CID 79145426

IUPAC[5-(ethoxymethyl)-1,3-oxazol-4-yl]methanol
SMILESCCOCc1ocnc1CO
InChIInChI=1S/C7H11NO3/c1-2-10-4-7-6(3-9)8-5-11-7/h5,9H,2-4H2,1H3
InChIKeyVMYVAAJNQYQIOT-UHFFFAOYSA-N
MW157.17 g/mol
LogP0.70
Rot. Bonds4

About [5-(ethoxymethyl)-1,3-oxazol-4-yl]methanol

[5-(ethoxymethyl)-1,3-oxazol-4-yl]methanol (PubChem CID 79145426) has the molecular formula C7H11NO3 and a molecular weight of 157.17 g/mol. Its IUPAC name is [5-(ethoxymethyl)-1,3-oxazol-4-yl]methanol.

Molecular Properties

Compound Name[5-(ethoxymethyl)-1,3-oxazol-4-yl]methanol
PubChem CID79145426
Molecular FormulaC7H11NO3
Molecular Weight157.17 g/mol
Exact Mass157.07
IUPAC Name[5-(ethoxymethyl)-1,3-oxazol-4-yl]methanol
SMILESCCOCc1ocnc1CO
InChIInChI=1S/C7H11NO3/c1-2-10-4-7-6(3-9)8-5-11-7/h5,9H,2-4H2,1H3
InChIKeyVMYVAAJNQYQIOT-UHFFFAOYSA-N
XLogP0.70
TPSA55.49 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.17
LogP ≤ 50.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [5-(ethoxymethyl)-1,3-oxazol-4-yl]methanol?
The IUPAC name of [5-(ethoxymethyl)-1,3-oxazol-4-yl]methanol (CID 79145426) is [5-(ethoxymethyl)-1,3-oxazol-4-yl]methanol.
What is the SMILES notation for [5-(ethoxymethyl)-1,3-oxazol-4-yl]methanol?
The canonical SMILES for [5-(ethoxymethyl)-1,3-oxazol-4-yl]methanol is CCOCc1ocnc1CO.
What is the InChIKey of [5-(ethoxymethyl)-1,3-oxazol-4-yl]methanol?
The InChIKey is VMYVAAJNQYQIOT-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11NO3/c1-2-10-4-7-6(3-9)8-5-11-7/h5,9H,2-4H2,1H3.
What are the key properties of [5-(ethoxymethyl)-1,3-oxazol-4-yl]methanol?
[5-(ethoxymethyl)-1,3-oxazol-4-yl]methanol has a molecular weight of 157.17 g/mol, XLogP of 0.70, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [5-(ethoxymethyl)-1,3-oxazol-4-yl]methanol is sourced from PubChem (CID 79145426), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).