3-(5-quinolin-6-yl-1,2,4-oxadiazol-3-yl)morpholine

C15H14N4O2 — CID 103971459

IUPAC3-(5-quinolin-6-yl-1,2,4-oxadiazol-3-yl)morpholine
SMILESc1cnc2ccc(-c3nc(C4COCCN4)no3)cc2c1
InChIInChI=1S/C15H14N4O2/c1-2-10-8-11(3-4-12(10)16-5-1)15-18-14(19-21-15)13-9-20-7-6-17-13/h1-5,8,13,17H,6-7,9H2
InChIKeyYHKLJSLJMVZXML-UHFFFAOYSA-N
MW282.30 g/mol
LogP1.95
Rot. Bonds2

About 3-(5-quinolin-6-yl-1,2,4-oxadiazol-3-yl)morpholine

3-(5-quinolin-6-yl-1,2,4-oxadiazol-3-yl)morpholine (PubChem CID 103971459) has the molecular formula C15H14N4O2 and a molecular weight of 282.30 g/mol. Its IUPAC name is 3-(5-quinolin-6-yl-1,2,4-oxadiazol-3-yl)morpholine.

Molecular Properties

Compound Name3-(5-quinolin-6-yl-1,2,4-oxadiazol-3-yl)morpholine
PubChem CID103971459
Molecular FormulaC15H14N4O2
Molecular Weight282.30 g/mol
Exact Mass282.11
IUPAC Name3-(5-quinolin-6-yl-1,2,4-oxadiazol-3-yl)morpholine
SMILESc1cnc2ccc(-c3nc(C4COCCN4)no3)cc2c1
InChIInChI=1S/C15H14N4O2/c1-2-10-8-11(3-4-12(10)16-5-1)15-18-14(19-21-15)13-9-20-7-6-17-13/h1-5,8,13,17H,6-7,9H2
InChIKeyYHKLJSLJMVZXML-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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Frequently Asked Questions

What is the IUPAC name of 3-(5-quinolin-6-yl-1,2,4-oxadiazol-3-yl)morpholine?
The IUPAC name of 3-(5-quinolin-6-yl-1,2,4-oxadiazol-3-yl)morpholine (CID 103971459) is 3-(5-quinolin-6-yl-1,2,4-oxadiazol-3-yl)morpholine.
What is the SMILES notation for 3-(5-quinolin-6-yl-1,2,4-oxadiazol-3-yl)morpholine?
The canonical SMILES for 3-(5-quinolin-6-yl-1,2,4-oxadiazol-3-yl)morpholine is c1cnc2ccc(-c3nc(C4COCCN4)no3)cc2c1.
What is the InChIKey of 3-(5-quinolin-6-yl-1,2,4-oxadiazol-3-yl)morpholine?
The InChIKey is YHKLJSLJMVZXML-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N4O2/c1-2-10-8-11(3-4-12(10)16-5-1)15-18-14(19-21-15)13-9-20-7-6-17-13/h1-5,8,13,17H,6-7,9H2.
What are the key properties of 3-(5-quinolin-6-yl-1,2,4-oxadiazol-3-yl)morpholine?
3-(5-quinolin-6-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-6-yl-1,2,4-oxadiazol-3-yl)morpholine is sourced from PubChem (CID 103971459), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).