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

C11H19N3O3 — CID 116702661

IUPAC3-[3-(1-methoxybutyl)-1,2,4-oxadiazol-5-yl]morpholine
SMILESCCCC(OC)c1noc(C2COCCN2)n1
InChIInChI=1S/C11H19N3O3/c1-3-4-9(15-2)10-13-11(17-14-10)8-7-16-6-5-12-8/h8-9,12H,3-7H2,1-2H3
InChIKeyMGVNTBQLXQKLRR-UHFFFAOYSA-N
MW241.29 g/mol
LogP1.22
Rot. Bonds5

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

3-[3-(1-methoxybutyl)-1,2,4-oxadiazol-5-yl]morpholine (PubChem CID 116702661) has the molecular formula C11H19N3O3 and a molecular weight of 241.29 g/mol. Its IUPAC name is 3-[3-(1-methoxybutyl)-1,2,4-oxadiazol-5-yl]morpholine.

Molecular Properties

Compound Name3-[3-(1-methoxybutyl)-1,2,4-oxadiazol-5-yl]morpholine
PubChem CID116702661
Molecular FormulaC11H19N3O3
Molecular Weight241.29 g/mol
Exact Mass241.14
IUPAC Name3-[3-(1-methoxybutyl)-1,2,4-oxadiazol-5-yl]morpholine
SMILESCCCC(OC)c1noc(C2COCCN2)n1
InChIInChI=1S/C11H19N3O3/c1-3-4-9(15-2)10-13-11(17-14-10)8-7-16-6-5-12-8/h8-9,12H,3-7H2,1-2H3
InChIKeyMGVNTBQLXQKLRR-UHFFFAOYSA-N
XLogP1.22
TPSA69.41 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.29
LogP ≤ 51.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

3-(1-methoxypropyl)-5-piperidin-2-yl-1,2,4-oxadiazole
CID 116701833
[4-[3-(1-methoxybutyl)-1,2,4-oxadiazol-5-yl]cyclohexyl]methanamine
CID 104963886
3-(5-heptan-4-yl-1,2,4-oxadiazol-3-yl)morpholine
CID 103971571
2-[3-(1-methoxybutyl)-1,2,4-oxadiazol-5-yl]-N-propylcyclohexan-1-amine
CID 116733253
N-cyclopropyl-3-(1-methoxybutyl)-1,2,4-oxadiazol-5-amine
CID 116730928
(3S,5R)-5-[3-(1-methoxypropyl)-1,2,4-oxadiazol-5-yl]pyrrolidin-3-ol
CID 106812910
3-[3-[2-(2,2,2-trifluoroethoxy)ethyl]-1,2,4-oxadiazol-5-yl]morpholine
CID 103146078
3-(1-methoxypropyl)-5-(2-methylpiperidin-4-yl)-1,2,4-oxadiazole
CID 106743655
3-(3-phenyl-1,2,4-oxadiazol-5-yl)morpholine;hydrochloride
CID 91663021
3-(1-ethoxybutyl)-5-(4-methylpyrrolidin-3-yl)-1,2,4-oxadiazole
CID 116702223
5-[3-(1-methoxybutyl)-1,2,4-oxadiazol-5-yl]benzene-1,3-diamine
CID 107811752
3-(1-methoxy-2-methylpropyl)-5-[(2S)-pyrrolidin-2-yl]-1,2,4-oxadiazole
CID 104900856

Frequently Asked Questions

What is the IUPAC name of 3-[3-(1-methoxybutyl)-1,2,4-oxadiazol-5-yl]morpholine?
The IUPAC name of 3-[3-(1-methoxybutyl)-1,2,4-oxadiazol-5-yl]morpholine (CID 116702661) is 3-[3-(1-methoxybutyl)-1,2,4-oxadiazol-5-yl]morpholine.
What is the SMILES notation for 3-[3-(1-methoxybutyl)-1,2,4-oxadiazol-5-yl]morpholine?
The canonical SMILES for 3-[3-(1-methoxybutyl)-1,2,4-oxadiazol-5-yl]morpholine is CCCC(OC)c1noc(C2COCCN2)n1.
What is the InChIKey of 3-[3-(1-methoxybutyl)-1,2,4-oxadiazol-5-yl]morpholine?
The InChIKey is MGVNTBQLXQKLRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O3/c1-3-4-9(15-2)10-13-11(17-14-10)8-7-16-6-5-12-8/h8-9,12H,3-7H2,1-2H3.
What are the key properties of 3-[3-(1-methoxybutyl)-1,2,4-oxadiazol-5-yl]morpholine?
3-[3-(1-methoxybutyl)-1,2,4-oxadiazol-5-yl]morpholine has a molecular weight of 241.29 g/mol, XLogP of 1.22, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[3-(1-methoxybutyl)-1,2,4-oxadiazol-5-yl]morpholine is sourced from PubChem (CID 116702661), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).