3-(5-methyl-1,2,4-oxadiazol-3-yl)morpholine

C7H11N3O2 — CID 75355392

IUPAC3-(5-methyl-1,2,4-oxadiazol-3-yl)morpholine
SMILESCc1nc(C2COCCN2)no1
InChIInChI=1S/C7H11N3O2/c1-5-9-7(10-12-5)6-4-11-3-2-8-6/h6,8H,2-4H2,1H3
InChIKeyDCASZZLXAHFAAN-UHFFFAOYSA-N
MW169.18 g/mol
LogP0.04
Rot. Bonds1

About 3-(5-methyl-1,2,4-oxadiazol-3-yl)morpholine

3-(5-methyl-1,2,4-oxadiazol-3-yl)morpholine (PubChem CID 75355392) has the molecular formula C7H11N3O2 and a molecular weight of 169.18 g/mol. Its IUPAC name is 3-(5-methyl-1,2,4-oxadiazol-3-yl)morpholine.

Molecular Properties

Compound Name3-(5-methyl-1,2,4-oxadiazol-3-yl)morpholine
PubChem CID75355392
Molecular FormulaC7H11N3O2
Molecular Weight169.18 g/mol
Exact Mass169.09
IUPAC Name3-(5-methyl-1,2,4-oxadiazol-3-yl)morpholine
SMILESCc1nc(C2COCCN2)no1
InChIInChI=1S/C7H11N3O2/c1-5-9-7(10-12-5)6-4-11-3-2-8-6/h6,8H,2-4H2,1H3
InChIKeyDCASZZLXAHFAAN-UHFFFAOYSA-N
XLogP0.04
TPSA60.18 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.18
LogP ≤ 50.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3-[5-(oxolan-3-yl)-1,2,4-oxadiazol-3-yl]morpholine
CID 103971742
3-[5-(2-methylphenyl)-1,2,4-oxadiazol-3-yl]morpholine
CID 113360104
3-[5-(5-methyl-1H-pyrazol-4-yl)-1,2,4-oxadiazol-3-yl]morpholine
CID 136883340
3-(5-heptan-4-yl-1,2,4-oxadiazol-3-yl)morpholine
CID 103971571
3-[5-(ethoxymethyl)-1,2,4-oxadiazol-3-yl]morpholine
CID 103971477
5-methyl-3-piperidin-2-yl-1,2,4-oxadiazole;dihydrochloride
CID 54592757
3-[5-(4,5-dimethylthiophen-2-yl)-1,2,4-oxadiazol-3-yl]morpholine
CID 113360122
3-[5-(2-chloro-3-methylphenyl)-1,2,4-oxadiazol-3-yl]morpholine
CID 103971569
3-[5-(3-chloro-2-methylphenyl)-1,2,4-oxadiazol-3-yl]morpholine
CID 107099560
3-[5-(4-tert-butylcyclohexyl)-1,2,4-oxadiazol-3-yl]morpholine
CID 103971647
3-[5-[(2-methylphenyl)methyl]-1,2,4-oxadiazol-3-yl]morpholine;hydrochloride
CID 75484037
3-[5-(5-bromo-4-methylthiophen-2-yl)-1,2,4-oxadiazol-3-yl]morpholine
CID 103971678

Frequently Asked Questions

What is the IUPAC name of 3-(5-methyl-1,2,4-oxadiazol-3-yl)morpholine?
The IUPAC name of 3-(5-methyl-1,2,4-oxadiazol-3-yl)morpholine (CID 75355392) is 3-(5-methyl-1,2,4-oxadiazol-3-yl)morpholine.
What is the SMILES notation for 3-(5-methyl-1,2,4-oxadiazol-3-yl)morpholine?
The canonical SMILES for 3-(5-methyl-1,2,4-oxadiazol-3-yl)morpholine is Cc1nc(C2COCCN2)no1.
What is the InChIKey of 3-(5-methyl-1,2,4-oxadiazol-3-yl)morpholine?
The InChIKey is DCASZZLXAHFAAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11N3O2/c1-5-9-7(10-12-5)6-4-11-3-2-8-6/h6,8H,2-4H2,1H3.
What are the key properties of 3-(5-methyl-1,2,4-oxadiazol-3-yl)morpholine?
3-(5-methyl-1,2,4-oxadiazol-3-yl)morpholine has a molecular weight of 169.18 g/mol, XLogP of 0.04, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(5-methyl-1,2,4-oxadiazol-3-yl)morpholine is sourced from PubChem (CID 75355392), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).