2-[(4-methoxyphenoxy)methyl]-1,3,4-oxadiazole

C10H10N2O3 — CID 927075

IUPAC2-[(4-methoxyphenoxy)methyl]-1,3,4-oxadiazole
SMILESCOc1ccc(OCc2nnco2)cc1
InChIInChI=1S/C10H10N2O3/c1-13-8-2-4-9(5-3-8)14-6-10-12-11-7-15-10/h2-5,7H,6H2,1H3
InChIKeyPDAUDZVLZVFBOR-UHFFFAOYSA-N
MW206.20 g/mol
LogP1.66
Rot. Bonds4

About 2-[(4-methoxyphenoxy)methyl]-1,3,4-oxadiazole

2-[(4-methoxyphenoxy)methyl]-1,3,4-oxadiazole (PubChem CID 927075) has the molecular formula C10H10N2O3 and a molecular weight of 206.20 g/mol. Its IUPAC name is 2-[(4-methoxyphenoxy)methyl]-1,3,4-oxadiazole.

Molecular Properties

Compound Name2-[(4-methoxyphenoxy)methyl]-1,3,4-oxadiazole
PubChem CID927075
Molecular FormulaC10H10N2O3
Molecular Weight206.20 g/mol
Exact Mass206.07
IUPAC Name2-[(4-methoxyphenoxy)methyl]-1,3,4-oxadiazole
SMILESCOc1ccc(OCc2nnco2)cc1
InChIInChI=1S/C10H10N2O3/c1-13-8-2-4-9(5-3-8)14-6-10-12-11-7-15-10/h2-5,7H,6H2,1H3
InChIKeyPDAUDZVLZVFBOR-UHFFFAOYSA-N
XLogP1.66
TPSA57.38 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.20
LogP ≤ 51.66
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 2-[(4-methoxyphenoxy)methyl]-1,3,4-oxadiazole 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 2-[(4-methoxyphenoxy)methyl]-1,3,4-oxadiazole?
The IUPAC name of 2-[(4-methoxyphenoxy)methyl]-1,3,4-oxadiazole (CID 927075) is 2-[(4-methoxyphenoxy)methyl]-1,3,4-oxadiazole.
What is the SMILES notation for 2-[(4-methoxyphenoxy)methyl]-1,3,4-oxadiazole?
The canonical SMILES for 2-[(4-methoxyphenoxy)methyl]-1,3,4-oxadiazole is COc1ccc(OCc2nnco2)cc1.
What is the InChIKey of 2-[(4-methoxyphenoxy)methyl]-1,3,4-oxadiazole?
The InChIKey is PDAUDZVLZVFBOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N2O3/c1-13-8-2-4-9(5-3-8)14-6-10-12-11-7-15-10/h2-5,7H,6H2,1H3.
What are the key properties of 2-[(4-methoxyphenoxy)methyl]-1,3,4-oxadiazole?
2-[(4-methoxyphenoxy)methyl]-1,3,4-oxadiazole has a molecular weight of 206.20 g/mol, XLogP of 1.66, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-methoxyphenoxy)methyl]-1,3,4-oxadiazole is sourced from PubChem (CID 927075), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).