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

C10H7F2NO2 — CID 79144669

IUPAC[5-(3,5-difluorophenyl)-1,3-oxazol-4-yl]methanol
SMILESOCc1ncoc1-c1cc(F)cc(F)c1
InChIInChI=1S/C10H7F2NO2/c11-7-1-6(2-8(12)3-7)10-9(4-14)13-5-15-10/h1-3,5,14H,4H2
InChIKeyPAHBUESOCZJMTR-UHFFFAOYSA-N
MW211.17 g/mol
LogP2.11
Rot. Bonds2

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

[5-(3,5-difluorophenyl)-1,3-oxazol-4-yl]methanol (PubChem CID 79144669) has the molecular formula C10H7F2NO2 and a molecular weight of 211.17 g/mol. Its IUPAC name is [5-(3,5-difluorophenyl)-1,3-oxazol-4-yl]methanol.

Molecular Properties

Compound Name[5-(3,5-difluorophenyl)-1,3-oxazol-4-yl]methanol
PubChem CID79144669
Molecular FormulaC10H7F2NO2
Molecular Weight211.17 g/mol
Exact Mass211.04
IUPAC Name[5-(3,5-difluorophenyl)-1,3-oxazol-4-yl]methanol
SMILESOCc1ncoc1-c1cc(F)cc(F)c1
InChIInChI=1S/C10H7F2NO2/c11-7-1-6(2-8(12)3-7)10-9(4-14)13-5-15-10/h1-3,5,14H,4H2
InChIKeyPAHBUESOCZJMTR-UHFFFAOYSA-N
XLogP2.11
TPSA46.26 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.17
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze [5-(3,5-difluorophenyl)-1,3-oxazol-4-yl]methanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of [5-(3,5-difluorophenyl)-1,3-oxazol-4-yl]methanol?
The IUPAC name of [5-(3,5-difluorophenyl)-1,3-oxazol-4-yl]methanol (CID 79144669) is [5-(3,5-difluorophenyl)-1,3-oxazol-4-yl]methanol.
What is the SMILES notation for [5-(3,5-difluorophenyl)-1,3-oxazol-4-yl]methanol?
The canonical SMILES for [5-(3,5-difluorophenyl)-1,3-oxazol-4-yl]methanol is OCc1ncoc1-c1cc(F)cc(F)c1.
What is the InChIKey of [5-(3,5-difluorophenyl)-1,3-oxazol-4-yl]methanol?
The InChIKey is PAHBUESOCZJMTR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7F2NO2/c11-7-1-6(2-8(12)3-7)10-9(4-14)13-5-15-10/h1-3,5,14H,4H2.
What are the key properties of [5-(3,5-difluorophenyl)-1,3-oxazol-4-yl]methanol?
[5-(3,5-difluorophenyl)-1,3-oxazol-4-yl]methanol has a molecular weight of 211.17 g/mol, XLogP of 2.11, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [5-(3,5-difluorophenyl)-1,3-oxazol-4-yl]methanol is sourced from PubChem (CID 79144669), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).