[2-[(E)-2-pyridin-4-ylethenyl]-1,3-oxazol-4-yl]methanol

C11H10N2O2 — CID 142575704

IUPAC[2-[(E)-2-pyridin-4-ylethenyl]-1,3-oxazol-4-yl]methanol
SMILESOCc1coc(/C=C/c2ccncc2)n1
InChIInChI=1S/C11H10N2O2/c14-7-10-8-15-11(13-10)2-1-9-3-5-12-6-4-9/h1-6,8,14H,7H2/b2-1+
InChIKeyFFVRRFUWQAODIS-OWOJBTEDSA-N
MW202.21 g/mol
LogP1.73
Rot. Bonds3

About [2-[(E)-2-pyridin-4-ylethenyl]-1,3-oxazol-4-yl]methanol

[2-[(E)-2-pyridin-4-ylethenyl]-1,3-oxazol-4-yl]methanol (PubChem CID 142575704) has the molecular formula C11H10N2O2 and a molecular weight of 202.21 g/mol. Its IUPAC name is [2-[(E)-2-pyridin-4-ylethenyl]-1,3-oxazol-4-yl]methanol.

Molecular Properties

Compound Name[2-[(E)-2-pyridin-4-ylethenyl]-1,3-oxazol-4-yl]methanol
PubChem CID142575704
Molecular FormulaC11H10N2O2
Molecular Weight202.21 g/mol
Exact Mass202.07
IUPAC Name[2-[(E)-2-pyridin-4-ylethenyl]-1,3-oxazol-4-yl]methanol
SMILESOCc1coc(/C=C/c2ccncc2)n1
InChIInChI=1S/C11H10N2O2/c14-7-10-8-15-11(13-10)2-1-9-3-5-12-6-4-9/h1-6,8,14H,7H2/b2-1+
InChIKeyFFVRRFUWQAODIS-OWOJBTEDSA-N
XLogP1.73
TPSA59.15 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.21
LogP ≤ 51.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [2-[(E)-2-pyridin-4-ylethenyl]-1,3-oxazol-4-yl]methanol?
The IUPAC name of [2-[(E)-2-pyridin-4-ylethenyl]-1,3-oxazol-4-yl]methanol (CID 142575704) is [2-[(E)-2-pyridin-4-ylethenyl]-1,3-oxazol-4-yl]methanol.
What is the SMILES notation for [2-[(E)-2-pyridin-4-ylethenyl]-1,3-oxazol-4-yl]methanol?
The canonical SMILES for [2-[(E)-2-pyridin-4-ylethenyl]-1,3-oxazol-4-yl]methanol is OCc1coc(/C=C/c2ccncc2)n1.
What is the InChIKey of [2-[(E)-2-pyridin-4-ylethenyl]-1,3-oxazol-4-yl]methanol?
The InChIKey is FFVRRFUWQAODIS-OWOJBTEDSA-N. The full InChI is InChI=1S/C11H10N2O2/c14-7-10-8-15-11(13-10)2-1-9-3-5-12-6-4-9/h1-6,8,14H,7H2/b2-1+.
What are the key properties of [2-[(E)-2-pyridin-4-ylethenyl]-1,3-oxazol-4-yl]methanol?
[2-[(E)-2-pyridin-4-ylethenyl]-1,3-oxazol-4-yl]methanol has a molecular weight of 202.21 g/mol, XLogP of 1.73, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[(E)-2-pyridin-4-ylethenyl]-1,3-oxazol-4-yl]methanol is sourced from PubChem (CID 142575704), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).