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

C13H14FN3O2 — CID 154757670

IUPAC2-(3-fluorophenyl)-4-(5-methyl-1,3,4-oxadiazol-2-yl)morpholine
SMILESCc1nnc(N2CCOC(c3cccc(F)c3)C2)o1
InChIInChI=1S/C13H14FN3O2/c1-9-15-16-13(19-9)17-5-6-18-12(8-17)10-3-2-4-11(14)7-10/h2-4,7,12H,5-6,8H2,1H3
InChIKeySPJSAUQBGJUBED-UHFFFAOYSA-N
MW263.27 g/mol
LogP2.10
Rot. Bonds2

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

2-(3-fluorophenyl)-4-(5-methyl-1,3,4-oxadiazol-2-yl)morpholine (PubChem CID 154757670) has the molecular formula C13H14FN3O2 and a molecular weight of 263.27 g/mol. Its IUPAC name is 2-(3-fluorophenyl)-4-(5-methyl-1,3,4-oxadiazol-2-yl)morpholine.

Molecular Properties

Compound Name2-(3-fluorophenyl)-4-(5-methyl-1,3,4-oxadiazol-2-yl)morpholine
PubChem CID154757670
Molecular FormulaC13H14FN3O2
Molecular Weight263.27 g/mol
Exact Mass263.11
IUPAC Name2-(3-fluorophenyl)-4-(5-methyl-1,3,4-oxadiazol-2-yl)morpholine
SMILESCc1nnc(N2CCOC(c3cccc(F)c3)C2)o1
InChIInChI=1S/C13H14FN3O2/c1-9-15-16-13(19-9)17-5-6-18-12(8-17)10-3-2-4-11(14)7-10/h2-4,7,12H,5-6,8H2,1H3
InChIKeySPJSAUQBGJUBED-UHFFFAOYSA-N
XLogP2.10
TPSA51.39 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.27
LogP ≤ 52.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(3-fluorophenyl)-4-(5-methyl-1,3,4-oxadiazol-2-yl)morpholine?
The IUPAC name of 2-(3-fluorophenyl)-4-(5-methyl-1,3,4-oxadiazol-2-yl)morpholine (CID 154757670) is 2-(3-fluorophenyl)-4-(5-methyl-1,3,4-oxadiazol-2-yl)morpholine.
What is the SMILES notation for 2-(3-fluorophenyl)-4-(5-methyl-1,3,4-oxadiazol-2-yl)morpholine?
The canonical SMILES for 2-(3-fluorophenyl)-4-(5-methyl-1,3,4-oxadiazol-2-yl)morpholine is Cc1nnc(N2CCOC(c3cccc(F)c3)C2)o1.
What is the InChIKey of 2-(3-fluorophenyl)-4-(5-methyl-1,3,4-oxadiazol-2-yl)morpholine?
The InChIKey is SPJSAUQBGJUBED-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14FN3O2/c1-9-15-16-13(19-9)17-5-6-18-12(8-17)10-3-2-4-11(14)7-10/h2-4,7,12H,5-6,8H2,1H3.
What are the key properties of 2-(3-fluorophenyl)-4-(5-methyl-1,3,4-oxadiazol-2-yl)morpholine?
2-(3-fluorophenyl)-4-(5-methyl-1,3,4-oxadiazol-2-yl)morpholine has a molecular weight of 263.27 g/mol, XLogP of 2.10, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-fluorophenyl)-4-(5-methyl-1,3,4-oxadiazol-2-yl)morpholine is sourced from PubChem (CID 154757670), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).