2-(2-methoxyphenyl)-5-(4-methylphenyl)-1,3,4-oxadiazole

C16H14N2O2 — CID 828055

IUPAC2-(2-methoxyphenyl)-5-(4-methylphenyl)-1,3,4-oxadiazole
SMILESCOc1ccccc1-c1nnc(-c2ccc(C)cc2)o1
InChIInChI=1S/C16H14N2O2/c1-11-7-9-12(10-8-11)15-17-18-16(20-15)13-5-3-4-6-14(13)19-2/h3-10H,1-2H3
InChIKeySTDLVJYILZRTNU-UHFFFAOYSA-N
MW266.30 g/mol
LogP3.72
Rot. Bonds3

About 2-(2-methoxyphenyl)-5-(4-methylphenyl)-1,3,4-oxadiazole

2-(2-methoxyphenyl)-5-(4-methylphenyl)-1,3,4-oxadiazole (PubChem CID 828055) has the molecular formula C16H14N2O2 and a molecular weight of 266.30 g/mol. Its IUPAC name is 2-(2-methoxyphenyl)-5-(4-methylphenyl)-1,3,4-oxadiazole.

Molecular Properties

Compound Name2-(2-methoxyphenyl)-5-(4-methylphenyl)-1,3,4-oxadiazole
PubChem CID828055
Molecular FormulaC16H14N2O2
Molecular Weight266.30 g/mol
Exact Mass266.11
IUPAC Name2-(2-methoxyphenyl)-5-(4-methylphenyl)-1,3,4-oxadiazole
SMILESCOc1ccccc1-c1nnc(-c2ccc(C)cc2)o1
InChIInChI=1S/C16H14N2O2/c1-11-7-9-12(10-8-11)15-17-18-16(20-15)13-5-3-4-6-14(13)19-2/h3-10H,1-2H3
InChIKeySTDLVJYILZRTNU-UHFFFAOYSA-N
XLogP3.72
TPSA48.15 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.30
LogP ≤ 53.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2-(4-Methoxyphenyl)-5-phenyl-1,3,4-oxadiazole
CID 70052
2-(2-Methoxyphenyl)-5-phenyl-1,3,4-oxadiazole
CID 74643
2-(4-Methoxyphenyl)-5-(4-methylphenyl)-1,3,4-oxadiazole
CID 622283
1,3,4-Oxadiazole, 2-amino-5-(o-methoxyphenyl)-
CID 201251
2-(3-Methoxyphenyl)-5-phenyl-1,3,4-oxadiazole
CID 74642
2-(4-Fluorophenyl)-5-(4-methoxyphenyl)-1,3,4-oxadiazole
CID 729586
2-(4-Methoxybenzyl)-5-phenyl-1,3,4-oxadiazole
CID 13004922
2-(4-Iodophenyl)-5-(4-methoxyphenyl)-1,3,4-oxadiazole
CID 46227022
Phenol, 2-[5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]-
CID 706782
2-(5-Phenyl-1,3,4-oxadiazol-2-yl)phenol
CID 300765
2-[2-(Trifluoromethoxy)phenyl]-5-[3-(trifluoromethyl)phenyl]-1,3,4-oxadiazole
CID 2744762
Isopropyl {[5-(2-methoxyphenyl)-1,3,4-oxadiazol-2-yl]thio}acetate
CID 673462

Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxyphenyl)-5-(4-methylphenyl)-1,3,4-oxadiazole?
The IUPAC name of 2-(2-methoxyphenyl)-5-(4-methylphenyl)-1,3,4-oxadiazole (CID 828055) is 2-(2-methoxyphenyl)-5-(4-methylphenyl)-1,3,4-oxadiazole.
What is the SMILES notation for 2-(2-methoxyphenyl)-5-(4-methylphenyl)-1,3,4-oxadiazole?
The canonical SMILES for 2-(2-methoxyphenyl)-5-(4-methylphenyl)-1,3,4-oxadiazole is COc1ccccc1-c1nnc(-c2ccc(C)cc2)o1.
What is the InChIKey of 2-(2-methoxyphenyl)-5-(4-methylphenyl)-1,3,4-oxadiazole?
The InChIKey is STDLVJYILZRTNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N2O2/c1-11-7-9-12(10-8-11)15-17-18-16(20-15)13-5-3-4-6-14(13)19-2/h3-10H,1-2H3.
What are the key properties of 2-(2-methoxyphenyl)-5-(4-methylphenyl)-1,3,4-oxadiazole?
2-(2-methoxyphenyl)-5-(4-methylphenyl)-1,3,4-oxadiazole has a molecular weight of 266.30 g/mol, XLogP of 3.72, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxyphenyl)-5-(4-methylphenyl)-1,3,4-oxadiazole is sourced from PubChem (CID 828055), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).