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

C13H15N3O3 — CID 47137708

IUPACN-ethyl-4-[(5-methyl-1,2,4-oxadiazol-3-yl)methoxy]benzamide
SMILESCCNC(=O)c1ccc(OCc2noc(C)n2)cc1
InChIInChI=1S/C13H15N3O3/c1-3-14-13(17)10-4-6-11(7-5-10)18-8-12-15-9(2)19-16-12/h4-7H,3,8H2,1-2H3,(H,14,17)
InChIKeyMFZRVLTVXWBXGB-UHFFFAOYSA-N
MW261.28 g/mol
LogP1.71
Rot. Bonds5

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

N-ethyl-4-[(5-methyl-1,2,4-oxadiazol-3-yl)methoxy]benzamide (PubChem CID 47137708) has the molecular formula C13H15N3O3 and a molecular weight of 261.28 g/mol. Its IUPAC name is N-ethyl-4-[(5-methyl-1,2,4-oxadiazol-3-yl)methoxy]benzamide.

Molecular Properties

Compound NameN-ethyl-4-[(5-methyl-1,2,4-oxadiazol-3-yl)methoxy]benzamide
PubChem CID47137708
Molecular FormulaC13H15N3O3
Molecular Weight261.28 g/mol
Exact Mass261.11
IUPAC NameN-ethyl-4-[(5-methyl-1,2,4-oxadiazol-3-yl)methoxy]benzamide
SMILESCCNC(=O)c1ccc(OCc2noc(C)n2)cc1
InChIInChI=1S/C13H15N3O3/c1-3-14-13(17)10-4-6-11(7-5-10)18-8-12-15-9(2)19-16-12/h4-7H,3,8H2,1-2H3,(H,14,17)
InChIKeyMFZRVLTVXWBXGB-UHFFFAOYSA-N
XLogP1.71
TPSA77.25 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.28
LogP ≤ 51.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[(2S)-3-methylbutan-2-yl]-4-[(5-methyl-1,2,4-oxadiazol-3-yl)methoxy]benzamide
CID 25362920
N,N-diethyl-4-[[4-[(5-methyl-1,2,4-oxadiazol-3-yl)methoxy]benzoyl]amino]benzamide
CID 32766350
benzyl 2-[[4-[(5-methyl-1,2,4-oxadiazol-3-yl)methoxy]benzoyl]amino]acetate
CID 55473566
[1-(ethylcarbamoylamino)-1-oxopropan-2-yl] 4-[(5-methyl-1,2,4-oxadiazol-3-yl)methoxy]benzoate
CID 55475355
N-[(1S)-1-cyclopropylethyl]-4-[(5-methyl-1,2,4-oxadiazol-3-yl)methoxy]benzamide
CID 32893352
4-[(5-methyl-1,2,4-oxadiazol-3-yl)methoxy]-N-[4-(phenylcarbamoylamino)phenyl]benzamide
CID 38476918
4-[(5-methyl-1,2,4-oxadiazol-3-yl)methoxy]-N-[3-[methyl(2,2,2-trifluoroethyl)amino]propyl]benzamide
CID 55712910
N-[(5-bromo-2-fluorophenyl)methyl]-4-[(5-methyl-1,2,4-oxadiazol-3-yl)methoxy]benzamide
CID 46592597
3-[2-[[4-[(5-methyl-1,2,4-oxadiazol-3-yl)methoxy]benzoyl]amino]ethyldisulfanyl]propanoic acid;2,2,2-trifluoroacetic acid
CID 166425113
N-(2,5-dimethoxyphenyl)-4-[(5-methyl-1,2,4-oxadiazol-3-yl)methoxy]benzamide
CID 51309899
N-[[4-[(4-hydroxypiperidin-1-yl)methyl]phenyl]methyl]-4-[(5-methyl-1,2,4-oxadiazol-3-yl)methoxy]benzamide
CID 56551658
N-[[4-[(2,6-dimethylmorpholin-4-yl)methyl]phenyl]methyl]-4-[(5-methyl-1,2,4-oxadiazol-3-yl)methoxy]benzamide
CID 55637352

Frequently Asked Questions

What is the IUPAC name of N-ethyl-4-[(5-methyl-1,2,4-oxadiazol-3-yl)methoxy]benzamide?
The IUPAC name of N-ethyl-4-[(5-methyl-1,2,4-oxadiazol-3-yl)methoxy]benzamide (CID 47137708) is N-ethyl-4-[(5-methyl-1,2,4-oxadiazol-3-yl)methoxy]benzamide.
What is the SMILES notation for N-ethyl-4-[(5-methyl-1,2,4-oxadiazol-3-yl)methoxy]benzamide?
The canonical SMILES for N-ethyl-4-[(5-methyl-1,2,4-oxadiazol-3-yl)methoxy]benzamide is CCNC(=O)c1ccc(OCc2noc(C)n2)cc1.
What is the InChIKey of N-ethyl-4-[(5-methyl-1,2,4-oxadiazol-3-yl)methoxy]benzamide?
The InChIKey is MFZRVLTVXWBXGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3O3/c1-3-14-13(17)10-4-6-11(7-5-10)18-8-12-15-9(2)19-16-12/h4-7H,3,8H2,1-2H3,(H,14,17).
What are the key properties of N-ethyl-4-[(5-methyl-1,2,4-oxadiazol-3-yl)methoxy]benzamide?
N-ethyl-4-[(5-methyl-1,2,4-oxadiazol-3-yl)methoxy]benzamide has a molecular weight of 261.28 g/mol, XLogP of 1.71, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-4-[(5-methyl-1,2,4-oxadiazol-3-yl)methoxy]benzamide is sourced from PubChem (CID 47137708), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).