2-[(5-benzyl-1,3,4-oxadiazol-2-yl)amino]-1-morpholin-4-ylethanone

C15H18N4O3 — CID 166241940

IUPAC2-[(5-benzyl-1,3,4-oxadiazol-2-yl)amino]-1-morpholin-4-ylethanone
SMILESO=C(CNc1nnc(Cc2ccccc2)o1)N1CCOCC1
InChIInChI=1S/C15H18N4O3/c20-14(19-6-8-21-9-7-19)11-16-15-18-17-13(22-15)10-12-4-2-1-3-5-12/h1-5H,6-11H2,(H,16,18)
InChIKeyIUIXBVURZKZQDG-UHFFFAOYSA-N
MW302.33 g/mol
LogP0.93
Rot. Bonds5

About 2-[(5-benzyl-1,3,4-oxadiazol-2-yl)amino]-1-morpholin-4-ylethanone

2-[(5-benzyl-1,3,4-oxadiazol-2-yl)amino]-1-morpholin-4-ylethanone (PubChem CID 166241940) has the molecular formula C15H18N4O3 and a molecular weight of 302.33 g/mol. Its IUPAC name is 2-[(5-benzyl-1,3,4-oxadiazol-2-yl)amino]-1-morpholin-4-ylethanone.

Molecular Properties

Compound Name2-[(5-benzyl-1,3,4-oxadiazol-2-yl)amino]-1-morpholin-4-ylethanone
PubChem CID166241940
Molecular FormulaC15H18N4O3
Molecular Weight302.33 g/mol
Exact Mass302.14
IUPAC Name2-[(5-benzyl-1,3,4-oxadiazol-2-yl)amino]-1-morpholin-4-ylethanone
SMILESO=C(CNc1nnc(Cc2ccccc2)o1)N1CCOCC1
InChIInChI=1S/C15H18N4O3/c20-14(19-6-8-21-9-7-19)11-16-15-18-17-13(22-15)10-12-4-2-1-3-5-12/h1-5H,6-11H2,(H,16,18)
InChIKeyIUIXBVURZKZQDG-UHFFFAOYSA-N
XLogP0.93
TPSA80.49 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500302.33
LogP ≤ 50.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2-(benzylamino)-1-morpholin-4-ylethanone
CID 23252432
1-morpholin-4-yl-2-(2-phenylmethoxyanilino)ethanone
CID 54828242
2-[[5-(chloromethyl)-1,3,4-oxadiazol-2-yl]amino]-1-piperidin-1-ylethanone
CID 106958394
(E)-N-(5-benzyl-1,3,4-oxadiazol-2-yl)-3-phenylprop-2-enamide
CID 16917343
1-(6-azaspiro[2.5]octan-6-yl)-2-[(5-phenyl-1,3,4-oxadiazol-2-yl)amino]ethanone
CID 171631786
1-morpholin-4-yl-3-phenylpropan-1-one
CID 532825
2-[(5-benzyl-1,3,4-oxadiazol-2-yl)sulfanyl]-1-(4-phenylpiperazin-1-yl)ethanone
CID 1008010
morpholin-4-yl-[5-(2-phenylethyl)-1,3,4-oxadiazol-2-yl]methanone
CID 110393378
1-morpholin-4-yl-2-[4-(3-phenylpropoxy)anilino]ethanone
CID 54825335
2-[(5-benzyl-1,3,4-oxadiazol-2-yl)sulfonyl]-1-(4-phenylpiperazin-1-yl)ethanone
CID 4588662
N-[[5-(2-morpholin-4-yl-2-oxoethyl)sulfanyl-1,3,4-oxadiazol-2-yl]methyl]benzamide
CID 7205201
N-(2-morpholin-4-yl-2-oxoethyl)-2,2-diphenylacetamide
CID 110712346

Frequently Asked Questions

What is the IUPAC name of 2-[(5-benzyl-1,3,4-oxadiazol-2-yl)amino]-1-morpholin-4-ylethanone?
The IUPAC name of 2-[(5-benzyl-1,3,4-oxadiazol-2-yl)amino]-1-morpholin-4-ylethanone (CID 166241940) is 2-[(5-benzyl-1,3,4-oxadiazol-2-yl)amino]-1-morpholin-4-ylethanone.
What is the SMILES notation for 2-[(5-benzyl-1,3,4-oxadiazol-2-yl)amino]-1-morpholin-4-ylethanone?
The canonical SMILES for 2-[(5-benzyl-1,3,4-oxadiazol-2-yl)amino]-1-morpholin-4-ylethanone is O=C(CNc1nnc(Cc2ccccc2)o1)N1CCOCC1.
What is the InChIKey of 2-[(5-benzyl-1,3,4-oxadiazol-2-yl)amino]-1-morpholin-4-ylethanone?
The InChIKey is IUIXBVURZKZQDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N4O3/c20-14(19-6-8-21-9-7-19)11-16-15-18-17-13(22-15)10-12-4-2-1-3-5-12/h1-5H,6-11H2,(H,16,18).
What are the key properties of 2-[(5-benzyl-1,3,4-oxadiazol-2-yl)amino]-1-morpholin-4-ylethanone?
2-[(5-benzyl-1,3,4-oxadiazol-2-yl)amino]-1-morpholin-4-ylethanone has a molecular weight of 302.33 g/mol, XLogP of 0.93, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(5-benzyl-1,3,4-oxadiazol-2-yl)amino]-1-morpholin-4-ylethanone is sourced from PubChem (CID 166241940), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).