4-[2-(5-phenyl-1,3,4-oxadiazol-2-yl)ethyl]morpholine

C14H17N3O2 — CID 110653646

IUPAC4-[2-(5-phenyl-1,3,4-oxadiazol-2-yl)ethyl]morpholine
SMILESc1ccc(-c2nnc(CCN3CCOCC3)o2)cc1
InChIInChI=1S/C14H17N3O2/c1-2-4-12(5-3-1)14-16-15-13(19-14)6-7-17-8-10-18-11-9-17/h1-5H,6-11H2
InChIKeyIJRYDUIOTKVADK-UHFFFAOYSA-N
MW259.31 g/mol
LogP1.61
Rot. Bonds4

About 4-[2-(5-phenyl-1,3,4-oxadiazol-2-yl)ethyl]morpholine

4-[2-(5-phenyl-1,3,4-oxadiazol-2-yl)ethyl]morpholine (PubChem CID 110653646) has the molecular formula C14H17N3O2 and a molecular weight of 259.31 g/mol. Its IUPAC name is 4-[2-(5-phenyl-1,3,4-oxadiazol-2-yl)ethyl]morpholine.

Molecular Properties

Compound Name4-[2-(5-phenyl-1,3,4-oxadiazol-2-yl)ethyl]morpholine
PubChem CID110653646
Molecular FormulaC14H17N3O2
Molecular Weight259.31 g/mol
Exact Mass259.13
IUPAC Name4-[2-(5-phenyl-1,3,4-oxadiazol-2-yl)ethyl]morpholine
SMILESc1ccc(-c2nnc(CCN3CCOCC3)o2)cc1
InChIInChI=1S/C14H17N3O2/c1-2-4-12(5-3-1)14-16-15-13(19-14)6-7-17-8-10-18-11-9-17/h1-5H,6-11H2
InChIKeyIJRYDUIOTKVADK-UHFFFAOYSA-N
XLogP1.61
TPSA51.39 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.31
LogP ≤ 51.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

2-phenyl-5-[2-(4-phenylpiperazin-1-yl)ethyl]-1,3,4-oxadiazole
CID 110653684
2-[2-(4-ethylsulfonylpiperazin-1-yl)ethyl]-5-phenyl-1,3,4-oxadiazole
CID 110658538
2-[2-(4-methylsulfonylpiperazin-1-yl)ethyl]-5-phenyl-1,3,4-oxadiazole
CID 110658537
phenyl-[4-[2-(5-phenyl-1,3,4-oxadiazol-2-yl)ethyl]piperazin-1-yl]methanone
CID 110658449
1-[4-[2-(5-phenyl-1,3,4-oxadiazol-2-yl)ethyl]piperazin-1-yl]propan-1-one
CID 110658437
2-methyl-1-[4-[2-(5-phenyl-1,3,4-oxadiazol-2-yl)ethyl]piperazin-1-yl]propan-1-one
CID 110658439
phenyl 4-[2-(5-phenyl-1,3,4-oxadiazol-2-yl)ethyl]piperazine-1-carboxylate
CID 110658516
2-ethyl-1-[4-[2-(5-phenyl-1,3,4-oxadiazol-2-yl)ethyl]piperazin-1-yl]butan-1-one
CID 110658447
4-[(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]-1,4-oxazepan-5-one
CID 72936466
2-[2-[4-(3-chlorophenyl)sulfonylpiperazin-1-yl]ethyl]-5-phenyl-1,3,4-oxadiazole
CID 110658604
2-phenyl-5-propyl-1,3,4-oxadiazole
CID 14949000
2-(2-chloroethyl)-5-phenyl-1,3,4-oxadiazole
CID 39242176

Frequently Asked Questions

What is the IUPAC name of 4-[2-(5-phenyl-1,3,4-oxadiazol-2-yl)ethyl]morpholine?
The IUPAC name of 4-[2-(5-phenyl-1,3,4-oxadiazol-2-yl)ethyl]morpholine (CID 110653646) is 4-[2-(5-phenyl-1,3,4-oxadiazol-2-yl)ethyl]morpholine.
What is the SMILES notation for 4-[2-(5-phenyl-1,3,4-oxadiazol-2-yl)ethyl]morpholine?
The canonical SMILES for 4-[2-(5-phenyl-1,3,4-oxadiazol-2-yl)ethyl]morpholine is c1ccc(-c2nnc(CCN3CCOCC3)o2)cc1.
What is the InChIKey of 4-[2-(5-phenyl-1,3,4-oxadiazol-2-yl)ethyl]morpholine?
The InChIKey is IJRYDUIOTKVADK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O2/c1-2-4-12(5-3-1)14-16-15-13(19-14)6-7-17-8-10-18-11-9-17/h1-5H,6-11H2.
What are the key properties of 4-[2-(5-phenyl-1,3,4-oxadiazol-2-yl)ethyl]morpholine?
4-[2-(5-phenyl-1,3,4-oxadiazol-2-yl)ethyl]morpholine has a molecular weight of 259.31 g/mol, XLogP of 1.61, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(5-phenyl-1,3,4-oxadiazol-2-yl)ethyl]morpholine is sourced from PubChem (CID 110653646), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).