2-[3-(3-hydroxyphenyl)-1,2,4-oxadiazol-5-yl]phenol

C14H10N2O3 — CID 136809760

IUPAC2-[3-(3-hydroxyphenyl)-1,2,4-oxadiazol-5-yl]phenol
SMILESOc1cccc(-c2noc(-c3ccccc3O)n2)c1
InChIInChI=1S/C14H10N2O3/c17-10-5-3-4-9(8-10)13-15-14(19-16-13)11-6-1-2-7-12(11)18/h1-8,17-18H
InChIKeyWVTNFKBINARCBL-UHFFFAOYSA-N
MW254.25 g/mol
LogP2.81
Rot. Bonds2

About 2-[3-(3-hydroxyphenyl)-1,2,4-oxadiazol-5-yl]phenol

2-[3-(3-hydroxyphenyl)-1,2,4-oxadiazol-5-yl]phenol (PubChem CID 136809760) has the molecular formula C14H10N2O3 and a molecular weight of 254.25 g/mol. Its IUPAC name is 2-[3-(3-hydroxyphenyl)-1,2,4-oxadiazol-5-yl]phenol.

Molecular Properties

Compound Name2-[3-(3-hydroxyphenyl)-1,2,4-oxadiazol-5-yl]phenol
PubChem CID136809760
Molecular FormulaC14H10N2O3
Molecular Weight254.25 g/mol
Exact Mass254.07
IUPAC Name2-[3-(3-hydroxyphenyl)-1,2,4-oxadiazol-5-yl]phenol
SMILESOc1cccc(-c2noc(-c3ccccc3O)n2)c1
InChIInChI=1S/C14H10N2O3/c17-10-5-3-4-9(8-10)13-15-14(19-16-13)11-6-1-2-7-12(11)18/h1-8,17-18H
InChIKeyWVTNFKBINARCBL-UHFFFAOYSA-N
XLogP2.81
TPSA79.38 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.25
LogP ≤ 52.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 2-[3-(3-hydroxyphenyl)-1,2,4-oxadiazol-5-yl]phenol 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-[5-(2-nitrophenyl)-1,2,4-oxadiazol-3-yl]phenol
CID 28942061
3-[5-(3-bromo-2-fluorophenyl)-1,2,4-oxadiazol-3-yl]phenol
CID 106704216
3-[5-(3-chloro-2-fluorophenyl)-1,2,4-oxadiazol-3-yl]phenol
CID 80979825
3-[5-(5-methyl-1,2-oxazol-4-yl)-1,2,4-oxadiazol-3-yl]phenol
CID 43120312
2-amino-4-[3-(3-hydroxyphenyl)-1,2,4-oxadiazol-5-yl]phenol
CID 136888758
3-[5-(2-methoxy-3-pyridinyl)-1,2,4-oxadiazol-3-yl]phenol
CID 62876336
2-fluoro-4-[5-(3-hydroxyphenyl)-1,2,4-oxadiazol-3-yl]phenol
CID 136871097
2-[3-(3-methoxyphenyl)-1,2,4-oxadiazol-5-yl]benzene-1,4-diol
CID 136904028
3-[5-(6-methyl-2-pyridinyl)-1,2,4-oxadiazol-3-yl]phenol
CID 43120309
2-[[3-(3-hydroxyphenyl)-1,2,4-oxadiazol-5-yl]methyl]phenol
CID 107922223
3-[5-(1,3-thiazol-4-yl)-1,2,4-oxadiazol-3-yl]phenol
CID 63022523
4-[3-(3-hydroxyphenyl)-1,2,4-oxadiazol-5-yl]-2-methoxyphenol
CID 136889520

Frequently Asked Questions

What is the IUPAC name of 2-[3-(3-hydroxyphenyl)-1,2,4-oxadiazol-5-yl]phenol?
The IUPAC name of 2-[3-(3-hydroxyphenyl)-1,2,4-oxadiazol-5-yl]phenol (CID 136809760) is 2-[3-(3-hydroxyphenyl)-1,2,4-oxadiazol-5-yl]phenol.
What is the SMILES notation for 2-[3-(3-hydroxyphenyl)-1,2,4-oxadiazol-5-yl]phenol?
The canonical SMILES for 2-[3-(3-hydroxyphenyl)-1,2,4-oxadiazol-5-yl]phenol is Oc1cccc(-c2noc(-c3ccccc3O)n2)c1.
What is the InChIKey of 2-[3-(3-hydroxyphenyl)-1,2,4-oxadiazol-5-yl]phenol?
The InChIKey is WVTNFKBINARCBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10N2O3/c17-10-5-3-4-9(8-10)13-15-14(19-16-13)11-6-1-2-7-12(11)18/h1-8,17-18H.
What are the key properties of 2-[3-(3-hydroxyphenyl)-1,2,4-oxadiazol-5-yl]phenol?
2-[3-(3-hydroxyphenyl)-1,2,4-oxadiazol-5-yl]phenol has a molecular weight of 254.25 g/mol, XLogP of 2.81, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(3-hydroxyphenyl)-1,2,4-oxadiazol-5-yl]phenol is sourced from PubChem (CID 136809760), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).