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

C11H20N4O2 — CID 138059178

IUPACN-ethyl-N-[(3-morpholin-2-yl-1,2,4-oxadiazol-5-yl)methyl]ethanamine
SMILESCCN(CC)Cc1nc(C2CNCCO2)no1
InChIInChI=1S/C11H20N4O2/c1-3-15(4-2)8-10-13-11(14-17-10)9-7-12-5-6-16-9/h9,12H,3-8H2,1-2H3
InChIKeyKWHOIJGPWHGIJK-UHFFFAOYSA-N
MW240.31 g/mol
LogP0.57
Rot. Bonds5

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

N-ethyl-N-[(3-morpholin-2-yl-1,2,4-oxadiazol-5-yl)methyl]ethanamine (PubChem CID 138059178) has the molecular formula C11H20N4O2 and a molecular weight of 240.31 g/mol. Its IUPAC name is N-ethyl-N-[(3-morpholin-2-yl-1,2,4-oxadiazol-5-yl)methyl]ethanamine.

Molecular Properties

Compound NameN-ethyl-N-[(3-morpholin-2-yl-1,2,4-oxadiazol-5-yl)methyl]ethanamine
PubChem CID138059178
Molecular FormulaC11H20N4O2
Molecular Weight240.31 g/mol
Exact Mass240.16
IUPAC NameN-ethyl-N-[(3-morpholin-2-yl-1,2,4-oxadiazol-5-yl)methyl]ethanamine
SMILESCCN(CC)Cc1nc(C2CNCCO2)no1
InChIInChI=1S/C11H20N4O2/c1-3-15(4-2)8-10-13-11(14-17-10)9-7-12-5-6-16-9/h9,12H,3-8H2,1-2H3
InChIKeyKWHOIJGPWHGIJK-UHFFFAOYSA-N
XLogP0.57
TPSA63.42 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.31
LogP ≤ 50.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2-[5-(methoxymethyl)-1,2,4-oxadiazol-3-yl]morpholine
CID 86276549
2-[5-(2,4,4-trimethylpentyl)-1,2,4-oxadiazol-3-yl]morpholine
CID 103971802
2-[5-(1-ethylcyclopentyl)-1,2,4-oxadiazol-3-yl]morpholine
CID 103971782
2-[5-[(2,6-difluorophenyl)methyl]-1,2,4-oxadiazol-3-yl]morpholine
CID 103972068
2-[5-(2-bicyclo[2.2.1]heptanylmethyl)-1,2,4-oxadiazol-3-yl]morpholine
CID 103972002
2-[5-(phenoxymethyl)-1,2,4-oxadiazol-3-yl]morpholine
CID 103971788
2-[5-(2-methyloxolan-3-yl)-1,2,4-oxadiazol-3-yl]morpholine
CID 103972028
2-[5-[(3-bromophenyl)methyl]-1,2,4-oxadiazol-3-yl]morpholine
CID 103971859
2-(5-cyclooctyl-1,2,4-oxadiazol-3-yl)morpholine
CID 103972025
2-(5-ethyl-1H-1,2,4-triazol-3-yl)morpholine;dihydrochloride
CID 167739757
2-[5-(1,3-dimethylpyrazol-4-yl)-1,2,4-oxadiazol-3-yl]morpholine
CID 103971863
2-(5-pyrimidin-5-yl-1,2,4-oxadiazol-3-yl)morpholine
CID 104630877

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-[(3-morpholin-2-yl-1,2,4-oxadiazol-5-yl)methyl]ethanamine?
The IUPAC name of N-ethyl-N-[(3-morpholin-2-yl-1,2,4-oxadiazol-5-yl)methyl]ethanamine (CID 138059178) is N-ethyl-N-[(3-morpholin-2-yl-1,2,4-oxadiazol-5-yl)methyl]ethanamine.
What is the SMILES notation for N-ethyl-N-[(3-morpholin-2-yl-1,2,4-oxadiazol-5-yl)methyl]ethanamine?
The canonical SMILES for N-ethyl-N-[(3-morpholin-2-yl-1,2,4-oxadiazol-5-yl)methyl]ethanamine is CCN(CC)Cc1nc(C2CNCCO2)no1.
What is the InChIKey of N-ethyl-N-[(3-morpholin-2-yl-1,2,4-oxadiazol-5-yl)methyl]ethanamine?
The InChIKey is KWHOIJGPWHGIJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N4O2/c1-3-15(4-2)8-10-13-11(14-17-10)9-7-12-5-6-16-9/h9,12H,3-8H2,1-2H3.
What are the key properties of N-ethyl-N-[(3-morpholin-2-yl-1,2,4-oxadiazol-5-yl)methyl]ethanamine?
N-ethyl-N-[(3-morpholin-2-yl-1,2,4-oxadiazol-5-yl)methyl]ethanamine has a molecular weight of 240.31 g/mol, XLogP of 0.57, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-[(3-morpholin-2-yl-1,2,4-oxadiazol-5-yl)methyl]ethanamine is sourced from PubChem (CID 138059178), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).