2-[5-(2-methyloxolan-3-yl)-1,2,4-oxadiazol-3-yl]morpholine

C11H17N3O3 — CID 103972028

IUPAC2-[5-(2-methyloxolan-3-yl)-1,2,4-oxadiazol-3-yl]morpholine
SMILESCC1OCCC1c1nc(C2CNCCO2)no1
InChIInChI=1S/C11H17N3O3/c1-7-8(2-4-15-7)11-13-10(14-17-11)9-6-12-3-5-16-9/h7-9,12H,2-6H2,1H3
InChIKeyMXTADCYAIXALRC-UHFFFAOYSA-N
MW239.27 g/mol
LogP0.62
Rot. Bonds2

About 2-[5-(2-methyloxolan-3-yl)-1,2,4-oxadiazol-3-yl]morpholine

2-[5-(2-methyloxolan-3-yl)-1,2,4-oxadiazol-3-yl]morpholine (PubChem CID 103972028) has the molecular formula C11H17N3O3 and a molecular weight of 239.27 g/mol. Its IUPAC name is 2-[5-(2-methyloxolan-3-yl)-1,2,4-oxadiazol-3-yl]morpholine.

Molecular Properties

Compound Name2-[5-(2-methyloxolan-3-yl)-1,2,4-oxadiazol-3-yl]morpholine
PubChem CID103972028
Molecular FormulaC11H17N3O3
Molecular Weight239.27 g/mol
Exact Mass239.13
IUPAC Name2-[5-(2-methyloxolan-3-yl)-1,2,4-oxadiazol-3-yl]morpholine
SMILESCC1OCCC1c1nc(C2CNCCO2)no1
InChIInChI=1S/C11H17N3O3/c1-7-8(2-4-15-7)11-13-10(14-17-11)9-6-12-3-5-16-9/h7-9,12H,2-6H2,1H3
InChIKeyMXTADCYAIXALRC-UHFFFAOYSA-N
XLogP0.62
TPSA69.41 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.27
LogP ≤ 50.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2-[5-(2-bicyclo[2.2.1]heptanyl)-1,2,4-oxadiazol-3-yl]morpholine
CID 103972015
2-(5-cyclooctyl-1,2,4-oxadiazol-3-yl)morpholine
CID 103972025
N-ethyl-N-[(3-morpholin-2-yl-1,2,4-oxadiazol-5-yl)methyl]ethanamine
CID 138059178
2-[5-(2,3-dihydro-1-benzofuran-3-yl)-1,2,4-oxadiazol-3-yl]morpholine
CID 103971991
2-[5-(methoxymethyl)-1,2,4-oxadiazol-3-yl]morpholine
CID 86276549
2-[5-(4,5,6,7-tetrahydro-1-benzothiophen-4-yl)-1,2,4-oxadiazol-3-yl]morpholine
CID 103971824
2-[5-(1-ethylcyclopentyl)-1,2,4-oxadiazol-3-yl]morpholine
CID 103971782
2-(5-pyrimidin-5-yl-1,2,4-oxadiazol-3-yl)morpholine
CID 104630877
3-(3-cyclopropyl-1,2,4-oxadiazol-5-yl)-2-methylmorpholine
CID 122236512
5-(3-methyloxan-4-yl)-3-piperidin-3-yl-1,2,4-oxadiazole
CID 114241654
2-[5-(1,2-oxazol-3-yl)-1,2,4-oxadiazol-3-yl]morpholine
CID 103971807
5-(2-methylcyclopropyl)-3-piperidin-3-yl-1,2,4-oxadiazole
CID 63026812

Frequently Asked Questions

What is the IUPAC name of 2-[5-(2-methyloxolan-3-yl)-1,2,4-oxadiazol-3-yl]morpholine?
The IUPAC name of 2-[5-(2-methyloxolan-3-yl)-1,2,4-oxadiazol-3-yl]morpholine (CID 103972028) is 2-[5-(2-methyloxolan-3-yl)-1,2,4-oxadiazol-3-yl]morpholine.
What is the SMILES notation for 2-[5-(2-methyloxolan-3-yl)-1,2,4-oxadiazol-3-yl]morpholine?
The canonical SMILES for 2-[5-(2-methyloxolan-3-yl)-1,2,4-oxadiazol-3-yl]morpholine is CC1OCCC1c1nc(C2CNCCO2)no1.
What is the InChIKey of 2-[5-(2-methyloxolan-3-yl)-1,2,4-oxadiazol-3-yl]morpholine?
The InChIKey is MXTADCYAIXALRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O3/c1-7-8(2-4-15-7)11-13-10(14-17-11)9-6-12-3-5-16-9/h7-9,12H,2-6H2,1H3.
What are the key properties of 2-[5-(2-methyloxolan-3-yl)-1,2,4-oxadiazol-3-yl]morpholine?
2-[5-(2-methyloxolan-3-yl)-1,2,4-oxadiazol-3-yl]morpholine has a molecular weight of 239.27 g/mol, XLogP of 0.62, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[5-(2-methyloxolan-3-yl)-1,2,4-oxadiazol-3-yl]morpholine is sourced from PubChem (CID 103972028), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).