2-ethyl-5-phenyl-1,3,4-oxadiazole

C10H10N2O — CID 12520828

IUPAC2-ethyl-5-phenyl-1,3,4-oxadiazole
SMILESCCc1nnc(-c2ccccc2)o1
InChIInChI=1S/C10H10N2O/c1-2-9-11-12-10(13-9)8-6-4-3-5-7-8/h3-7H,2H2,1H3
InChIKeyRSAJTPXSNJSNGW-UHFFFAOYSA-N
MW174.20 g/mol
LogP2.30
Rot. Bonds2

About 2-ethyl-5-phenyl-1,3,4-oxadiazole

2-ethyl-5-phenyl-1,3,4-oxadiazole (PubChem CID 12520828) has the molecular formula C10H10N2O and a molecular weight of 174.20 g/mol. Its IUPAC name is 2-ethyl-5-phenyl-1,3,4-oxadiazole.

Molecular Properties

Compound Name2-ethyl-5-phenyl-1,3,4-oxadiazole
PubChem CID12520828
Molecular FormulaC10H10N2O
Molecular Weight174.20 g/mol
Exact Mass174.08
IUPAC Name2-ethyl-5-phenyl-1,3,4-oxadiazole
SMILESCCc1nnc(-c2ccccc2)o1
InChIInChI=1S/C10H10N2O/c1-2-9-11-12-10(13-9)8-6-4-3-5-7-8/h3-7H,2H2,1H3
InChIKeyRSAJTPXSNJSNGW-UHFFFAOYSA-N
XLogP2.30
TPSA38.92 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.20
LogP ≤ 52.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-phenyl-5-propyl-1,3,4-oxadiazole
CID 14949000
ethane;2-(methylsulfanylmethyl)-5-phenyl-1,3,4-oxadiazole
CID 178170665
2-(2-chloroethyl)-5-phenyl-1,3,4-oxadiazole
CID 39242176
1-(5-phenyl-1,3,4-oxadiazol-2-yl)propan-2-amine
CID 84671547
3-methyl-N-[(5-phenyl-1,3,4-oxadiazol-2-yl)methyl]pentan-3-amine
CID 103746773
ethane;2-phenyl-5-[4-(5-phenyl-1,3,4-oxadiazol-2-yl)phenyl]-1,3,4-oxadiazole
CID 144770943
2-ethyl-5-(4-methyl-2-phenyl-1,3-thiazol-5-yl)-1,3,4-oxadiazole
CID 71563462
N-methyl-N-[[5-(4-phenylphenyl)-1,3,4-oxadiazol-2-yl]methyl]aniline
CID 162418406
4-ethyl-N-[2-(5-phenyl-1,3,4-oxadiazol-2-yl)ethyl]aniline
CID 110653733
N-ethyl-2-(5-phenyl-1,3,4-oxadiazol-2-yl)acetamide
CID 46249412
bis(2,2-dimethylpropane);2,5-diphenyl-1,3,4-oxadiazole
CID 160836587
N-methyl-N-[2-(5-phenyl-1,3,4-oxadiazol-2-yl)ethyl]butan-1-amine
CID 110653712

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-5-phenyl-1,3,4-oxadiazole?
The IUPAC name of 2-ethyl-5-phenyl-1,3,4-oxadiazole (CID 12520828) is 2-ethyl-5-phenyl-1,3,4-oxadiazole.
What is the SMILES notation for 2-ethyl-5-phenyl-1,3,4-oxadiazole?
The canonical SMILES for 2-ethyl-5-phenyl-1,3,4-oxadiazole is CCc1nnc(-c2ccccc2)o1.
What is the InChIKey of 2-ethyl-5-phenyl-1,3,4-oxadiazole?
The InChIKey is RSAJTPXSNJSNGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N2O/c1-2-9-11-12-10(13-9)8-6-4-3-5-7-8/h3-7H,2H2,1H3.
What are the key properties of 2-ethyl-5-phenyl-1,3,4-oxadiazole?
2-ethyl-5-phenyl-1,3,4-oxadiazole has a molecular weight of 174.20 g/mol, XLogP of 2.30, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-5-phenyl-1,3,4-oxadiazole is sourced from PubChem (CID 12520828), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).