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

C15H19N3O3 — CID 42919025

IUPAC4-[1-[5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]ethyl]morpholine
SMILESCOc1ccc(-c2nnc(C(C)N3CCOCC3)o2)cc1
InChIInChI=1S/C15H19N3O3/c1-11(18-7-9-20-10-8-18)14-16-17-15(21-14)12-3-5-13(19-2)6-4-12/h3-6,11H,7-10H2,1-2H3
InChIKeyRMIBHXDDIUPWJT-UHFFFAOYSA-N
MW289.33 g/mol
LogP2.14
Rot. Bonds4

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

4-[1-[5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]ethyl]morpholine (PubChem CID 42919025) has the molecular formula C15H19N3O3 and a molecular weight of 289.33 g/mol. Its IUPAC name is 4-[1-[5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]ethyl]morpholine.

Molecular Properties

Compound Name4-[1-[5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]ethyl]morpholine
PubChem CID42919025
Molecular FormulaC15H19N3O3
Molecular Weight289.33 g/mol
Exact Mass289.14
IUPAC Name4-[1-[5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]ethyl]morpholine
SMILESCOc1ccc(-c2nnc(C(C)N3CCOCC3)o2)cc1
InChIInChI=1S/C15H19N3O3/c1-11(18-7-9-20-10-8-18)14-16-17-15(21-14)12-3-5-13(19-2)6-4-12/h3-6,11H,7-10H2,1-2H3
InChIKeyRMIBHXDDIUPWJT-UHFFFAOYSA-N
XLogP2.14
TPSA60.62 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.33
LogP ≤ 52.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

2-(4-Methoxyphenyl)-5-phenyl-1,3,4-oxadiazole
CID 70052
2-[[5-(4-Methoxyphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]-1-piperidin-1-ylethanone
CID 865334
2-(4-Ethoxy-phenyl)-5-phenyl-[1,3,4]oxadiazole
CID 865999
[3-[3-Fluoro-4-[(4-methylpiperazin-1-yl)methyl]phenoxy]azetidin-1-yl]-[5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]methanone
CID 56597991
[3-[4-[(Dimethylamino)methyl]phenoxy]azetidin-1-yl]-[5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]methanone
CID 56598130
2,5-Bis(4-methoxyphenyl)-1,3,4-oxadiazole
CID 70059
4-(1,3,4-Oxadiazol-2-yl)phenyl morpholine-4-carboxylate
CID 700115
2-(4-Methoxyphenyl)-5-propyl-1,3,4-oxadiazole
CID 833644
2-(4-Isobutoxy-phenyl)-5-(4-methoxy-phenyl)-[1,3,4]oxadiazole
CID 863663
2-(4-Ethoxy-phenyl)-5-(4-methoxy-phenyl)-[1,3,4]oxadiazole
CID 866008
2-[[5-[4-(Difluoromethoxy)phenyl]-1,3,4-oxadiazol-2-yl]sulfanyl]-1-morpholin-4-ylethanone
CID 2681272
1-(3,5-Dimethylpiperidin-1-yl)-2-[4-(1,3,4-oxadiazol-2-yl)phenoxy]ethanone
CID 2999070

Frequently Asked Questions

What is the IUPAC name of 4-[1-[5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]ethyl]morpholine?
The IUPAC name of 4-[1-[5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]ethyl]morpholine (CID 42919025) is 4-[1-[5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]ethyl]morpholine.
What is the SMILES notation for 4-[1-[5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]ethyl]morpholine?
The canonical SMILES for 4-[1-[5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]ethyl]morpholine is COc1ccc(-c2nnc(C(C)N3CCOCC3)o2)cc1.
What is the InChIKey of 4-[1-[5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]ethyl]morpholine?
The InChIKey is RMIBHXDDIUPWJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O3/c1-11(18-7-9-20-10-8-18)14-16-17-15(21-14)12-3-5-13(19-2)6-4-12/h3-6,11H,7-10H2,1-2H3.
What are the key properties of 4-[1-[5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]ethyl]morpholine?
4-[1-[5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]ethyl]morpholine has a molecular weight of 289.33 g/mol, XLogP of 2.14, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[1-[5-(4-methoxyphenyl)-1,3,4-oxadiazol-2-yl]ethyl]morpholine is sourced from PubChem (CID 42919025), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).