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

C15H14N4O2 — CID 103971456

IUPAC3-(5-quinolin-4-yl-1,2,4-oxadiazol-3-yl)morpholine
SMILESc1ccc2c(-c3nc(C4COCCN4)no3)ccnc2c1
InChIInChI=1S/C15H14N4O2/c1-2-4-12-10(3-1)11(5-6-16-12)15-18-14(19-21-15)13-9-20-8-7-17-13/h1-6,13,17H,7-9H2
InChIKeyDNHMULYKACCMNU-UHFFFAOYSA-N
MW282.30 g/mol
LogP1.95
Rot. Bonds2

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

3-(5-quinolin-4-yl-1,2,4-oxadiazol-3-yl)morpholine (PubChem CID 103971456) has the molecular formula C15H14N4O2 and a molecular weight of 282.30 g/mol. Its IUPAC name is 3-(5-quinolin-4-yl-1,2,4-oxadiazol-3-yl)morpholine.

Molecular Properties

Compound Name3-(5-quinolin-4-yl-1,2,4-oxadiazol-3-yl)morpholine
PubChem CID103971456
Molecular FormulaC15H14N4O2
Molecular Weight282.30 g/mol
Exact Mass282.11
IUPAC Name3-(5-quinolin-4-yl-1,2,4-oxadiazol-3-yl)morpholine
SMILESc1ccc2c(-c3nc(C4COCCN4)no3)ccnc2c1
InChIInChI=1S/C15H14N4O2/c1-2-4-12-10(3-1)11(5-6-16-12)15-18-14(19-21-15)13-9-20-8-7-17-13/h1-6,13,17H,7-9H2
InChIKeyDNHMULYKACCMNU-UHFFFAOYSA-N
XLogP1.95
TPSA73.07 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.30
LogP ≤ 51.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

3-[5-(2-methylphenyl)-1,2,4-oxadiazol-3-yl]morpholine
CID 113360104
3-(5-quinolin-8-yl-1,2,4-oxadiazol-3-yl)morpholine
CID 103971488
3-(5-quinolin-6-yl-1,2,4-oxadiazol-3-yl)morpholine
CID 103971459
3-[(3R)-oxolan-3-yl]-5-quinolin-5-yl-1,2,4-oxadiazole
CID 97446166
3-(5-naphthalen-2-yl-1,2,4-oxadiazol-3-yl)morpholine
CID 75484051
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-pyrazin-2-yl-1,2,4-oxadiazol-3-yl)morpholine
CID 103971687
3-[5-(5-methyl-1H-pyrazol-4-yl)-1,2,4-oxadiazol-3-yl]morpholine
CID 136883340
3-[5-(4-ethoxyphenyl)-1,2,4-oxadiazol-3-yl]morpholine;hydrochloride
CID 75484039
3-[5-(3-ethyl-6-methylpyridazin-4-yl)-1,2,4-oxadiazol-3-yl]morpholine
CID 104672077
3-piperidin-2-yl-5-quinoxalin-5-yl-1,2,4-oxadiazole
CID 104615591

Frequently Asked Questions

What is the IUPAC name of 3-(5-quinolin-4-yl-1,2,4-oxadiazol-3-yl)morpholine?
The IUPAC name of 3-(5-quinolin-4-yl-1,2,4-oxadiazol-3-yl)morpholine (CID 103971456) is 3-(5-quinolin-4-yl-1,2,4-oxadiazol-3-yl)morpholine.
What is the SMILES notation for 3-(5-quinolin-4-yl-1,2,4-oxadiazol-3-yl)morpholine?
The canonical SMILES for 3-(5-quinolin-4-yl-1,2,4-oxadiazol-3-yl)morpholine is c1ccc2c(-c3nc(C4COCCN4)no3)ccnc2c1.
What is the InChIKey of 3-(5-quinolin-4-yl-1,2,4-oxadiazol-3-yl)morpholine?
The InChIKey is DNHMULYKACCMNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N4O2/c1-2-4-12-10(3-1)11(5-6-16-12)15-18-14(19-21-15)13-9-20-8-7-17-13/h1-6,13,17H,7-9H2.
What are the key properties of 3-(5-quinolin-4-yl-1,2,4-oxadiazol-3-yl)morpholine?
3-(5-quinolin-4-yl-1,2,4-oxadiazol-3-yl)morpholine has a molecular weight of 282.30 g/mol, XLogP of 1.95, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(5-quinolin-4-yl-1,2,4-oxadiazol-3-yl)morpholine is sourced from PubChem (CID 103971456), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).