2-(2-phenoxyethyl)-5-phenyl-1,3,4-oxadiazole

C16H14N2O2 — CID 110656027

IUPAC2-(2-phenoxyethyl)-5-phenyl-1,3,4-oxadiazole
SMILESc1ccc(OCCc2nnc(-c3ccccc3)o2)cc1
InChIInChI=1S/C16H14N2O2/c1-3-7-13(8-4-1)16-18-17-15(20-16)11-12-19-14-9-5-2-6-10-14/h1-10H,11-12H2
InChIKeyYDDOGPPGEPEHSJ-UHFFFAOYSA-N
MW266.30 g/mol
LogP3.36
Rot. Bonds5

About 2-(2-phenoxyethyl)-5-phenyl-1,3,4-oxadiazole

2-(2-phenoxyethyl)-5-phenyl-1,3,4-oxadiazole (PubChem CID 110656027) has the molecular formula C16H14N2O2 and a molecular weight of 266.30 g/mol. Its IUPAC name is 2-(2-phenoxyethyl)-5-phenyl-1,3,4-oxadiazole.

Molecular Properties

Compound Name2-(2-phenoxyethyl)-5-phenyl-1,3,4-oxadiazole
PubChem CID110656027
Molecular FormulaC16H14N2O2
Molecular Weight266.30 g/mol
Exact Mass266.11
IUPAC Name2-(2-phenoxyethyl)-5-phenyl-1,3,4-oxadiazole
SMILESc1ccc(OCCc2nnc(-c3ccccc3)o2)cc1
InChIInChI=1S/C16H14N2O2/c1-3-7-13(8-4-1)16-18-17-15(20-16)11-12-19-14-9-5-2-6-10-14/h1-10H,11-12H2
InChIKeyYDDOGPPGEPEHSJ-UHFFFAOYSA-N
XLogP3.36
TPSA48.15 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.30
LogP ≤ 53.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2-[2-(4-bromophenoxy)ethyl]-5-phenyl-1,3,4-oxadiazole
CID 110656038
2-[2-(3-chlorophenoxy)ethyl]-5-phenyl-1,3,4-oxadiazole
CID 110656035
2-phenyl-5-propyl-1,3,4-oxadiazole
CID 14949000
2-(2-chloroethyl)-5-phenyl-1,3,4-oxadiazole
CID 39242176
5-(2-phenoxyethyl)-1,3,4-oxadiazole-2-carboxylic acid
CID 112619546
2-[2-(2-chloro-5-methylphenoxy)ethyl]-5-phenyl-1,3,4-oxadiazole
CID 110656079
2-[(4-bromophenoxy)methyl]-5-phenyl-1,3,4-oxadiazole
CID 18859382
1-[5-(2-phenoxyethyl)-1,3,4-oxadiazol-2-yl]propan-1-amine
CID 62857431
2-[4-(4-chlorobutoxy)phenyl]-5-phenyl-1,3,4-oxadiazole
CID 71406447
2-(4-methoxyphenyl)-5-(2-phenoxyethylsulfanylmethyl)-1,3,4-oxadiazole
CID 142831314
N,N-dimethyl-3-[4-[5-(7-phenylheptyl)-1,3,4-oxadiazol-2-yl]phenoxy]propan-1-amine
CID 21108907
(2S)-1-phenoxy-N-[(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]propan-2-amine
CID 95131861

Frequently Asked Questions

What is the IUPAC name of 2-(2-phenoxyethyl)-5-phenyl-1,3,4-oxadiazole?
The IUPAC name of 2-(2-phenoxyethyl)-5-phenyl-1,3,4-oxadiazole (CID 110656027) is 2-(2-phenoxyethyl)-5-phenyl-1,3,4-oxadiazole.
What is the SMILES notation for 2-(2-phenoxyethyl)-5-phenyl-1,3,4-oxadiazole?
The canonical SMILES for 2-(2-phenoxyethyl)-5-phenyl-1,3,4-oxadiazole is c1ccc(OCCc2nnc(-c3ccccc3)o2)cc1.
What is the InChIKey of 2-(2-phenoxyethyl)-5-phenyl-1,3,4-oxadiazole?
The InChIKey is YDDOGPPGEPEHSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N2O2/c1-3-7-13(8-4-1)16-18-17-15(20-16)11-12-19-14-9-5-2-6-10-14/h1-10H,11-12H2.
What are the key properties of 2-(2-phenoxyethyl)-5-phenyl-1,3,4-oxadiazole?
2-(2-phenoxyethyl)-5-phenyl-1,3,4-oxadiazole has a molecular weight of 266.30 g/mol, XLogP of 3.36, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-phenoxyethyl)-5-phenyl-1,3,4-oxadiazole is sourced from PubChem (CID 110656027), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).