2-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-N-(2-phenoxyethoxy)acetamide

C19H19N3O5 — CID 110632975

IUPAC2-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-N-(2-phenoxyethoxy)acetamide
SMILESCOc1ccc(-c2noc(CC(=O)NOCCOc3ccccc3)n2)cc1
InChIInChI=1S/C19H19N3O5/c1-24-15-9-7-14(8-10-15)19-20-18(27-22-19)13-17(23)21-26-12-11-25-16-5-3-2-4-6-16/h2-10H,11-13H2,1H3,(H,21,23)
InChIKeyJKNXJFFYISJSDN-UHFFFAOYSA-N
MW369.38 g/mol
LogP2.41
Rot. Bonds9

About 2-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-N-(2-phenoxyethoxy)acetamide

2-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-N-(2-phenoxyethoxy)acetamide (PubChem CID 110632975) has the molecular formula C19H19N3O5 and a molecular weight of 369.38 g/mol. Its IUPAC name is 2-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-N-(2-phenoxyethoxy)acetamide.

Molecular Properties

Compound Name2-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-N-(2-phenoxyethoxy)acetamide
PubChem CID110632975
Molecular FormulaC19H19N3O5
Molecular Weight369.38 g/mol
Exact Mass369.13
IUPAC Name2-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-N-(2-phenoxyethoxy)acetamide
SMILESCOc1ccc(-c2noc(CC(=O)NOCCOc3ccccc3)n2)cc1
InChIInChI=1S/C19H19N3O5/c1-24-15-9-7-14(8-10-15)19-20-18(27-22-19)13-17(23)21-26-12-11-25-16-5-3-2-4-6-16/h2-10H,11-13H2,1H3,(H,21,23)
InChIKeyJKNXJFFYISJSDN-UHFFFAOYSA-N
XLogP2.41
TPSA95.71 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds9
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.38
LogP ≤ 52.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze 2-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-N-(2-phenoxyethoxy)acetamide 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

N-[2-[[2-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]acetyl]amino]ethyl]benzamide
CID 110630603
N-[[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl]-N-methyl-4-phenoxybutanamide
CID 8875186
4-methoxy-N-(2-phenoxyethoxy)benzamide
CID 110294662
N-[2-(2-fluorophenyl)ethyl]-2-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]acetamide
CID 110411078
2-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-N-methyl-N-phenylacetamide
CID 6625938
5-(4-methoxyphenyl)-5-oxo-N-(2-phenoxyethoxy)pentanamide
CID 110311300
ethyl 2-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]acetate
CID 79474663
[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl 2-(4-phenylmethoxyphenoxy)acetate
CID 29364003
N-(4-acetamidobutyl)-2-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]acetamide
CID 110609812
benzyl N-[[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methyl]carbamate
CID 110323055
2-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-N-(6-methoxy-3-pyridinyl)acetamide
CID 110620811
3-(4-methoxyphenyl)-5-[(4-phenylphenyl)methyl]-1,2,4-oxadiazole
CID 8895154

Frequently Asked Questions

What is the IUPAC name of 2-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-N-(2-phenoxyethoxy)acetamide?
The IUPAC name of 2-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-N-(2-phenoxyethoxy)acetamide (CID 110632975) is 2-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-N-(2-phenoxyethoxy)acetamide.
What is the SMILES notation for 2-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-N-(2-phenoxyethoxy)acetamide?
The canonical SMILES for 2-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-N-(2-phenoxyethoxy)acetamide is COc1ccc(-c2noc(CC(=O)NOCCOc3ccccc3)n2)cc1.
What is the InChIKey of 2-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-N-(2-phenoxyethoxy)acetamide?
The InChIKey is JKNXJFFYISJSDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N3O5/c1-24-15-9-7-14(8-10-15)19-20-18(27-22-19)13-17(23)21-26-12-11-25-16-5-3-2-4-6-16/h2-10H,11-13H2,1H3,(H,21,23).
What are the key properties of 2-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-N-(2-phenoxyethoxy)acetamide?
2-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-N-(2-phenoxyethoxy)acetamide has a molecular weight of 369.38 g/mol, XLogP of 2.41, 9 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(4-methoxyphenyl)-1,2,4-oxadiazol-5-yl]-N-(2-phenoxyethoxy)acetamide is sourced from PubChem (CID 110632975), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).