[2-[3-(2-methoxyphenyl)-1,2,4-oxadiazol-5-yl]phenyl]-morpholin-4-ylmethanone

C20H19N3O4 — CID 665787

IUPAC[2-[3-(2-methoxyphenyl)-1,2,4-oxadiazol-5-yl]phenyl]-morpholin-4-ylmethanone
SMILESCOc1ccccc1-c1noc(-c2ccccc2C(=O)N2CCOCC2)n1
InChIInChI=1S/C20H19N3O4/c1-25-17-9-5-4-8-16(17)18-21-19(27-22-18)14-6-2-3-7-15(14)20(24)23-10-12-26-13-11-23/h2-9H,10-13H2,1H3
InChIKeyXLCSLTMUNACESK-UHFFFAOYSA-N
MW365.39 g/mol
LogP2.88
Rot. Bonds4

About [2-[3-(2-methoxyphenyl)-1,2,4-oxadiazol-5-yl]phenyl]-morpholin-4-ylmethanone

[2-[3-(2-methoxyphenyl)-1,2,4-oxadiazol-5-yl]phenyl]-morpholin-4-ylmethanone (PubChem CID 665787) has the molecular formula C20H19N3O4 and a molecular weight of 365.39 g/mol. Its IUPAC name is [2-[3-(2-methoxyphenyl)-1,2,4-oxadiazol-5-yl]phenyl]-morpholin-4-ylmethanone.

Molecular Properties

Compound Name[2-[3-(2-methoxyphenyl)-1,2,4-oxadiazol-5-yl]phenyl]-morpholin-4-ylmethanone
PubChem CID665787
Molecular FormulaC20H19N3O4
Molecular Weight365.39 g/mol
Exact Mass365.14
IUPAC Name[2-[3-(2-methoxyphenyl)-1,2,4-oxadiazol-5-yl]phenyl]-morpholin-4-ylmethanone
SMILESCOc1ccccc1-c1noc(-c2ccccc2C(=O)N2CCOCC2)n1
InChIInChI=1S/C20H19N3O4/c1-25-17-9-5-4-8-16(17)18-21-19(27-22-18)14-6-2-3-7-15(14)20(24)23-10-12-26-13-11-23/h2-9H,10-13H2,1H3
InChIKeyXLCSLTMUNACESK-UHFFFAOYSA-N
XLogP2.88
TPSA77.69 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.39
LogP ≤ 52.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze [2-[3-(2-methoxyphenyl)-1,2,4-oxadiazol-5-yl]phenyl]-morpholin-4-ylmethanone 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-[3-(2-methoxyphenyl)-1,2,4-oxadiazol-5-yl]phenyl]-morpholin-4-ylmethanone?
The IUPAC name of [2-[3-(2-methoxyphenyl)-1,2,4-oxadiazol-5-yl]phenyl]-morpholin-4-ylmethanone (CID 665787) is [2-[3-(2-methoxyphenyl)-1,2,4-oxadiazol-5-yl]phenyl]-morpholin-4-ylmethanone.
What is the SMILES notation for [2-[3-(2-methoxyphenyl)-1,2,4-oxadiazol-5-yl]phenyl]-morpholin-4-ylmethanone?
The canonical SMILES for [2-[3-(2-methoxyphenyl)-1,2,4-oxadiazol-5-yl]phenyl]-morpholin-4-ylmethanone is COc1ccccc1-c1noc(-c2ccccc2C(=O)N2CCOCC2)n1.
What is the InChIKey of [2-[3-(2-methoxyphenyl)-1,2,4-oxadiazol-5-yl]phenyl]-morpholin-4-ylmethanone?
The InChIKey is XLCSLTMUNACESK-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19N3O4/c1-25-17-9-5-4-8-16(17)18-21-19(27-22-18)14-6-2-3-7-15(14)20(24)23-10-12-26-13-11-23/h2-9H,10-13H2,1H3.
What are the key properties of [2-[3-(2-methoxyphenyl)-1,2,4-oxadiazol-5-yl]phenyl]-morpholin-4-ylmethanone?
[2-[3-(2-methoxyphenyl)-1,2,4-oxadiazol-5-yl]phenyl]-morpholin-4-ylmethanone has a molecular weight of 365.39 g/mol, XLogP of 2.88, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[3-(2-methoxyphenyl)-1,2,4-oxadiazol-5-yl]phenyl]-morpholin-4-ylmethanone is sourced from PubChem (CID 665787), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).