N-ethyl-N-[(3-fluorophenyl)methyl]-2-[(5-methyl-1,2,4-oxadiazol-3-yl)methoxy]benzamide

C20H20FN3O3 — CID 46534337

IUPACN-ethyl-N-[(3-fluorophenyl)methyl]-2-[(5-methyl-1,2,4-oxadiazol-3-yl)methoxy]benzamide
SMILESCCN(Cc1cccc(F)c1)C(=O)c1ccccc1OCc1noc(C)n1
InChIInChI=1S/C20H20FN3O3/c1-3-24(12-15-7-6-8-16(21)11-15)20(25)17-9-4-5-10-18(17)26-13-19-22-14(2)27-23-19/h4-11H,3,12-13H2,1-2H3
InChIKeyBDMWLMJIVFMTRN-UHFFFAOYSA-N
MW369.40 g/mol
LogP3.76
Rot. Bonds7

About N-ethyl-N-[(3-fluorophenyl)methyl]-2-[(5-methyl-1,2,4-oxadiazol-3-yl)methoxy]benzamide

N-ethyl-N-[(3-fluorophenyl)methyl]-2-[(5-methyl-1,2,4-oxadiazol-3-yl)methoxy]benzamide (PubChem CID 46534337) has the molecular formula C20H20FN3O3 and a molecular weight of 369.40 g/mol. Its IUPAC name is N-ethyl-N-[(3-fluorophenyl)methyl]-2-[(5-methyl-1,2,4-oxadiazol-3-yl)methoxy]benzamide.

Molecular Properties

Compound NameN-ethyl-N-[(3-fluorophenyl)methyl]-2-[(5-methyl-1,2,4-oxadiazol-3-yl)methoxy]benzamide
PubChem CID46534337
Molecular FormulaC20H20FN3O3
Molecular Weight369.40 g/mol
Exact Mass369.15
IUPAC NameN-ethyl-N-[(3-fluorophenyl)methyl]-2-[(5-methyl-1,2,4-oxadiazol-3-yl)methoxy]benzamide
SMILESCCN(Cc1cccc(F)c1)C(=O)c1ccccc1OCc1noc(C)n1
InChIInChI=1S/C20H20FN3O3/c1-3-24(12-15-7-6-8-16(21)11-15)20(25)17-9-4-5-10-18(17)26-13-19-22-14(2)27-23-19/h4-11H,3,12-13H2,1-2H3
InChIKeyBDMWLMJIVFMTRN-UHFFFAOYSA-N
XLogP3.76
TPSA68.46 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.40
LogP ≤ 53.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

N-(4-fluorophenyl)-2-[(5-methyl-1,2,4-oxadiazol-3-yl)methoxy]benzamide
CID 31301282
N-ethyl-N-[(3-fluorophenyl)methyl]-5-methyl-1,2-oxazole-3-carboxamide
CID 51073091
2-bromo-N-ethyl-N-[(3-fluorophenyl)methyl]benzamide
CID 60655580
2-[(5-methyl-1,2,4-oxadiazol-3-yl)methoxy]-N-(2,2,2-trifluoroethyl)benzamide
CID 51075427
2-[(5-methyl-1,2,4-oxadiazol-3-yl)methoxy]-N-quinolin-3-ylbenzamide
CID 31031173
2-[(5-methyl-1,2,4-oxadiazol-3-yl)methoxy]-N-[3-(trifluoromethyl)phenyl]benzamide
CID 31301441
2-[[2-[(5-methyl-1,2,4-oxadiazol-3-yl)methoxy]benzoyl]amino]butanoic acid
CID 119224012
N-(3,5-dichlorophenyl)-2-[(5-methyl-1,2,4-oxadiazol-3-yl)methoxy]benzamide
CID 16579605
N-benzyl-N-ethyl-4-fluoro-2-methylbenzamide
CID 115745298
N-ethyl-N-[(3-fluorophenyl)methyl]-2-propylsulfonylbenzamide
CID 55669173
N-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]-2-[(5-methyl-1,2,4-oxadiazol-3-yl)methoxy]benzamide
CID 86822452
5-chloro-N-ethyl-N-[(3-fluorophenyl)methyl]-2-methoxypyridine-3-carboxamide
CID 171547530

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-[(3-fluorophenyl)methyl]-2-[(5-methyl-1,2,4-oxadiazol-3-yl)methoxy]benzamide?
The IUPAC name of N-ethyl-N-[(3-fluorophenyl)methyl]-2-[(5-methyl-1,2,4-oxadiazol-3-yl)methoxy]benzamide (CID 46534337) is N-ethyl-N-[(3-fluorophenyl)methyl]-2-[(5-methyl-1,2,4-oxadiazol-3-yl)methoxy]benzamide.
What is the SMILES notation for N-ethyl-N-[(3-fluorophenyl)methyl]-2-[(5-methyl-1,2,4-oxadiazol-3-yl)methoxy]benzamide?
The canonical SMILES for N-ethyl-N-[(3-fluorophenyl)methyl]-2-[(5-methyl-1,2,4-oxadiazol-3-yl)methoxy]benzamide is CCN(Cc1cccc(F)c1)C(=O)c1ccccc1OCc1noc(C)n1.
What is the InChIKey of N-ethyl-N-[(3-fluorophenyl)methyl]-2-[(5-methyl-1,2,4-oxadiazol-3-yl)methoxy]benzamide?
The InChIKey is BDMWLMJIVFMTRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20FN3O3/c1-3-24(12-15-7-6-8-16(21)11-15)20(25)17-9-4-5-10-18(17)26-13-19-22-14(2)27-23-19/h4-11H,3,12-13H2,1-2H3.
What are the key properties of N-ethyl-N-[(3-fluorophenyl)methyl]-2-[(5-methyl-1,2,4-oxadiazol-3-yl)methoxy]benzamide?
N-ethyl-N-[(3-fluorophenyl)methyl]-2-[(5-methyl-1,2,4-oxadiazol-3-yl)methoxy]benzamide has a molecular weight of 369.40 g/mol, XLogP of 3.76, 7 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-[(3-fluorophenyl)methyl]-2-[(5-methyl-1,2,4-oxadiazol-3-yl)methoxy]benzamide is sourced from PubChem (CID 46534337), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).