2-[2-(2-fluorophenoxy)ethyl-methylamino]-N-[5-[(2R)-oxolan-2-yl]-1,3,4-oxadiazol-2-yl]acetamide

C17H21FN4O4 — CID 52522772

IUPAC2-[2-(2-fluorophenoxy)ethyl-methylamino]-N-[5-[(2R)-oxolan-2-yl]-1,3,4-oxadiazol-2-yl]acetamide
SMILESCN(CCOc1ccccc1F)CC(=O)Nc1nnc([C@H]2CCCO2)o1
InChIInChI=1S/C17H21FN4O4/c1-22(8-10-25-13-6-3-2-5-12(13)18)11-15(23)19-17-21-20-16(26-17)14-7-4-9-24-14/h2-3,5-6,14H,4,7-11H2,1H3,(H,19,21,23)/t14-/m1/s1
InChIKeyVQOVUOWAWXJPKZ-CQSZACIVSA-N
MW364.38 g/mol
LogP2.01
Rot. Bonds8

About 2-[2-(2-fluorophenoxy)ethyl-methylamino]-N-[5-[(2R)-oxolan-2-yl]-1,3,4-oxadiazol-2-yl]acetamide

2-[2-(2-fluorophenoxy)ethyl-methylamino]-N-[5-[(2R)-oxolan-2-yl]-1,3,4-oxadiazol-2-yl]acetamide (PubChem CID 52522772) has the molecular formula C17H21FN4O4 and a molecular weight of 364.38 g/mol. Its IUPAC name is 2-[2-(2-fluorophenoxy)ethyl-methylamino]-N-[5-[(2R)-oxolan-2-yl]-1,3,4-oxadiazol-2-yl]acetamide.

Molecular Properties

Compound Name2-[2-(2-fluorophenoxy)ethyl-methylamino]-N-[5-[(2R)-oxolan-2-yl]-1,3,4-oxadiazol-2-yl]acetamide
PubChem CID52522772
Molecular FormulaC17H21FN4O4
Molecular Weight364.38 g/mol
Exact Mass364.15
IUPAC Name2-[2-(2-fluorophenoxy)ethyl-methylamino]-N-[5-[(2R)-oxolan-2-yl]-1,3,4-oxadiazol-2-yl]acetamide
SMILESCN(CCOc1ccccc1F)CC(=O)Nc1nnc([C@H]2CCCO2)o1
InChIInChI=1S/C17H21FN4O4/c1-22(8-10-25-13-6-3-2-5-12(13)18)11-15(23)19-17-21-20-16(26-17)14-7-4-9-24-14/h2-3,5-6,14H,4,7-11H2,1H3,(H,19,21,23)/t14-/m1/s1
InChIKeyVQOVUOWAWXJPKZ-CQSZACIVSA-N
XLogP2.01
TPSA89.72 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds8
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.38
LogP ≤ 52.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 2-[2-(2-fluorophenoxy)ethyl-methylamino]-N-[5-[(2R)-oxolan-2-yl]-1,3,4-oxadiazol-2-yl]acetamide 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-[2-(2-fluorophenoxy)ethyl-methylamino]-N-[5-[(2R)-oxolan-2-yl]-1,3,4-oxadiazol-2-yl]acetamide?
The IUPAC name of 2-[2-(2-fluorophenoxy)ethyl-methylamino]-N-[5-[(2R)-oxolan-2-yl]-1,3,4-oxadiazol-2-yl]acetamide (CID 52522772) is 2-[2-(2-fluorophenoxy)ethyl-methylamino]-N-[5-[(2R)-oxolan-2-yl]-1,3,4-oxadiazol-2-yl]acetamide.
What is the SMILES notation for 2-[2-(2-fluorophenoxy)ethyl-methylamino]-N-[5-[(2R)-oxolan-2-yl]-1,3,4-oxadiazol-2-yl]acetamide?
The canonical SMILES for 2-[2-(2-fluorophenoxy)ethyl-methylamino]-N-[5-[(2R)-oxolan-2-yl]-1,3,4-oxadiazol-2-yl]acetamide is CN(CCOc1ccccc1F)CC(=O)Nc1nnc([C@H]2CCCO2)o1.
What is the InChIKey of 2-[2-(2-fluorophenoxy)ethyl-methylamino]-N-[5-[(2R)-oxolan-2-yl]-1,3,4-oxadiazol-2-yl]acetamide?
The InChIKey is VQOVUOWAWXJPKZ-CQSZACIVSA-N. The full InChI is InChI=1S/C17H21FN4O4/c1-22(8-10-25-13-6-3-2-5-12(13)18)11-15(23)19-17-21-20-16(26-17)14-7-4-9-24-14/h2-3,5-6,14H,4,7-11H2,1H3,(H,19,21,23)/t14-/m1/s1.
What are the key properties of 2-[2-(2-fluorophenoxy)ethyl-methylamino]-N-[5-[(2R)-oxolan-2-yl]-1,3,4-oxadiazol-2-yl]acetamide?
2-[2-(2-fluorophenoxy)ethyl-methylamino]-N-[5-[(2R)-oxolan-2-yl]-1,3,4-oxadiazol-2-yl]acetamide has a molecular weight of 364.38 g/mol, XLogP of 2.01, 8 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2-fluorophenoxy)ethyl-methylamino]-N-[5-[(2R)-oxolan-2-yl]-1,3,4-oxadiazol-2-yl]acetamide is sourced from PubChem (CID 52522772), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).