4-[(6-fluoroquinolin-8-yl)methyl]-2-(5-methyl-1,2,4-oxadiazol-3-yl)morpholine

C17H17FN4O2 — CID 75480248

IUPAC4-[(6-fluoroquinolin-8-yl)methyl]-2-(5-methyl-1,2,4-oxadiazol-3-yl)morpholine
SMILESCc1nc(C2CN(Cc3cc(F)cc4cccnc34)CCO2)no1
InChIInChI=1S/C17H17FN4O2/c1-11-20-17(21-24-11)15-10-22(5-6-23-15)9-13-8-14(18)7-12-3-2-4-19-16(12)13/h2-4,7-8,15H,5-6,9-10H2,1H3
InChIKeyMOEFPCLYWSGKKN-UHFFFAOYSA-N
MW328.35 g/mol
LogP2.64
Rot. Bonds3

About 4-[(6-fluoroquinolin-8-yl)methyl]-2-(5-methyl-1,2,4-oxadiazol-3-yl)morpholine

4-[(6-fluoroquinolin-8-yl)methyl]-2-(5-methyl-1,2,4-oxadiazol-3-yl)morpholine (PubChem CID 75480248) has the molecular formula C17H17FN4O2 and a molecular weight of 328.35 g/mol. Its IUPAC name is 4-[(6-fluoroquinolin-8-yl)methyl]-2-(5-methyl-1,2,4-oxadiazol-3-yl)morpholine.

Molecular Properties

Compound Name4-[(6-fluoroquinolin-8-yl)methyl]-2-(5-methyl-1,2,4-oxadiazol-3-yl)morpholine
PubChem CID75480248
Molecular FormulaC17H17FN4O2
Molecular Weight328.35 g/mol
Exact Mass328.13
IUPAC Name4-[(6-fluoroquinolin-8-yl)methyl]-2-(5-methyl-1,2,4-oxadiazol-3-yl)morpholine
SMILESCc1nc(C2CN(Cc3cc(F)cc4cccnc34)CCO2)no1
InChIInChI=1S/C17H17FN4O2/c1-11-20-17(21-24-11)15-10-22(5-6-23-15)9-13-8-14(18)7-12-3-2-4-19-16(12)13/h2-4,7-8,15H,5-6,9-10H2,1H3
InChIKeyMOEFPCLYWSGKKN-UHFFFAOYSA-N
XLogP2.64
TPSA64.28 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.35
LogP ≤ 52.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 4-[(6-fluoroquinolin-8-yl)methyl]-2-(5-methyl-1,2,4-oxadiazol-3-yl)morpholine?
The IUPAC name of 4-[(6-fluoroquinolin-8-yl)methyl]-2-(5-methyl-1,2,4-oxadiazol-3-yl)morpholine (CID 75480248) is 4-[(6-fluoroquinolin-8-yl)methyl]-2-(5-methyl-1,2,4-oxadiazol-3-yl)morpholine.
What is the SMILES notation for 4-[(6-fluoroquinolin-8-yl)methyl]-2-(5-methyl-1,2,4-oxadiazol-3-yl)morpholine?
The canonical SMILES for 4-[(6-fluoroquinolin-8-yl)methyl]-2-(5-methyl-1,2,4-oxadiazol-3-yl)morpholine is Cc1nc(C2CN(Cc3cc(F)cc4cccnc34)CCO2)no1.
What is the InChIKey of 4-[(6-fluoroquinolin-8-yl)methyl]-2-(5-methyl-1,2,4-oxadiazol-3-yl)morpholine?
The InChIKey is MOEFPCLYWSGKKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17FN4O2/c1-11-20-17(21-24-11)15-10-22(5-6-23-15)9-13-8-14(18)7-12-3-2-4-19-16(12)13/h2-4,7-8,15H,5-6,9-10H2,1H3.
What are the key properties of 4-[(6-fluoroquinolin-8-yl)methyl]-2-(5-methyl-1,2,4-oxadiazol-3-yl)morpholine?
4-[(6-fluoroquinolin-8-yl)methyl]-2-(5-methyl-1,2,4-oxadiazol-3-yl)morpholine has a molecular weight of 328.35 g/mol, XLogP of 2.64, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(6-fluoroquinolin-8-yl)methyl]-2-(5-methyl-1,2,4-oxadiazol-3-yl)morpholine is sourced from PubChem (CID 75480248), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).