[3-(3-fluorophenyl)-5-(4-methylphenyl)-1,2-oxazol-4-yl]methanol

C17H14FNO2 — CID 131867751

IUPAC[3-(3-fluorophenyl)-5-(4-methylphenyl)-1,2-oxazol-4-yl]methanol
SMILESCc1ccc(-c2onc(-c3cccc(F)c3)c2CO)cc1
InChIInChI=1S/C17H14FNO2/c1-11-5-7-12(8-6-11)17-15(10-20)16(19-21-17)13-3-2-4-14(18)9-13/h2-9,20H,10H2,1H3
InChIKeyWLKUEJAVFBTIAK-UHFFFAOYSA-N
MW283.30 g/mol
LogP3.95
Rot. Bonds3

About [3-(3-fluorophenyl)-5-(4-methylphenyl)-1,2-oxazol-4-yl]methanol

[3-(3-fluorophenyl)-5-(4-methylphenyl)-1,2-oxazol-4-yl]methanol (PubChem CID 131867751) has the molecular formula C17H14FNO2 and a molecular weight of 283.30 g/mol. Its IUPAC name is [3-(3-fluorophenyl)-5-(4-methylphenyl)-1,2-oxazol-4-yl]methanol.

Molecular Properties

Compound Name[3-(3-fluorophenyl)-5-(4-methylphenyl)-1,2-oxazol-4-yl]methanol
PubChem CID131867751
Molecular FormulaC17H14FNO2
Molecular Weight283.30 g/mol
Exact Mass283.10
IUPAC Name[3-(3-fluorophenyl)-5-(4-methylphenyl)-1,2-oxazol-4-yl]methanol
SMILESCc1ccc(-c2onc(-c3cccc(F)c3)c2CO)cc1
InChIInChI=1S/C17H14FNO2/c1-11-5-7-12(8-6-11)17-15(10-20)16(19-21-17)13-3-2-4-14(18)9-13/h2-9,20H,10H2,1H3
InChIKeyWLKUEJAVFBTIAK-UHFFFAOYSA-N
XLogP3.95
TPSA46.26 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.30
LogP ≤ 53.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze [3-(3-fluorophenyl)-5-(4-methylphenyl)-1,2-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

Related Compounds

[3-(3-fluorophenyl)-5-(4-fluorophenyl)-1,2-oxazol-4-yl]methanol
CID 131868204
[3-(2,3-difluorophenyl)-5-(4-methylphenyl)-1,2-oxazol-4-yl]methanol
CID 131868496
[3-(2-chloro-6-fluorophenyl)-5-(4-methylphenyl)-1,2-oxazol-4-yl]methanol
CID 131868178
[5-(4-chlorophenyl)-3-(3-methoxyphenyl)-1,2-oxazol-4-yl]methanol
CID 131868442
[5-(3,5-dimethylphenyl)-3-(3-phenoxyphenyl)-1,2-oxazol-4-yl]methanol
CID 131868258
[3-(2,3-difluorophenyl)-5-(4-fluorophenyl)-1,2-oxazol-4-yl]methanol
CID 131868233
[5-(4-chlorophenyl)-3-phenyl-1,2-oxazol-4-yl]methanol
CID 131868430
[3-phenyl-5-[4-(trifluoromethyl)phenyl]-1,2-oxazol-4-yl]methanol
CID 131866937
[5-phenyl-3-[4-(trifluoromethyl)phenyl]-1,2-oxazol-4-yl]methanol
CID 131868158
[5-(4-chlorophenyl)-3-(2,4-difluorophenyl)-1,2-oxazol-4-yl]methanol
CID 131866897
[3-(2,3-difluorophenyl)-5-(3,5-difluorophenyl)-1,2-oxazol-4-yl]methanol
CID 131868157
[3-(3,5-difluorophenyl)-5-(2-fluorophenyl)-1,2-oxazol-4-yl]methanol
CID 131868050

Frequently Asked Questions

What is the IUPAC name of [3-(3-fluorophenyl)-5-(4-methylphenyl)-1,2-oxazol-4-yl]methanol?
The IUPAC name of [3-(3-fluorophenyl)-5-(4-methylphenyl)-1,2-oxazol-4-yl]methanol (CID 131867751) is [3-(3-fluorophenyl)-5-(4-methylphenyl)-1,2-oxazol-4-yl]methanol.
What is the SMILES notation for [3-(3-fluorophenyl)-5-(4-methylphenyl)-1,2-oxazol-4-yl]methanol?
The canonical SMILES for [3-(3-fluorophenyl)-5-(4-methylphenyl)-1,2-oxazol-4-yl]methanol is Cc1ccc(-c2onc(-c3cccc(F)c3)c2CO)cc1.
What is the InChIKey of [3-(3-fluorophenyl)-5-(4-methylphenyl)-1,2-oxazol-4-yl]methanol?
The InChIKey is WLKUEJAVFBTIAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14FNO2/c1-11-5-7-12(8-6-11)17-15(10-20)16(19-21-17)13-3-2-4-14(18)9-13/h2-9,20H,10H2,1H3.
What are the key properties of [3-(3-fluorophenyl)-5-(4-methylphenyl)-1,2-oxazol-4-yl]methanol?
[3-(3-fluorophenyl)-5-(4-methylphenyl)-1,2-oxazol-4-yl]methanol has a molecular weight of 283.30 g/mol, XLogP of 3.95, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(3-fluorophenyl)-5-(4-methylphenyl)-1,2-oxazol-4-yl]methanol is sourced from PubChem (CID 131867751), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).