2-(3-methyl-6-quinolin-6-ylpyrazin-2-yl)-5-phenyl-1,3,4-oxadiazole

C22H15N5O — CID 121399760

IUPAC2-(3-methyl-6-quinolin-6-ylpyrazin-2-yl)-5-phenyl-1,3,4-oxadiazole
SMILESCc1ncc(-c2ccc3ncccc3c2)nc1-c1nnc(-c2ccccc2)o1
InChIInChI=1S/C22H15N5O/c1-14-20(22-27-26-21(28-22)15-6-3-2-4-7-15)25-19(13-24-14)17-9-10-18-16(12-17)8-5-11-23-18/h2-13H,1H3
InChIKeyMSNOEJUHIXDYCZ-UHFFFAOYSA-N
MW365.40 g/mol
LogP4.72
Rot. Bonds3

About 2-(3-methyl-6-quinolin-6-ylpyrazin-2-yl)-5-phenyl-1,3,4-oxadiazole

2-(3-methyl-6-quinolin-6-ylpyrazin-2-yl)-5-phenyl-1,3,4-oxadiazole (PubChem CID 121399760) has the molecular formula C22H15N5O and a molecular weight of 365.40 g/mol. Its IUPAC name is 2-(3-methyl-6-quinolin-6-ylpyrazin-2-yl)-5-phenyl-1,3,4-oxadiazole.

Molecular Properties

Compound Name2-(3-methyl-6-quinolin-6-ylpyrazin-2-yl)-5-phenyl-1,3,4-oxadiazole
PubChem CID121399760
Molecular FormulaC22H15N5O
Molecular Weight365.40 g/mol
Exact Mass365.13
IUPAC Name2-(3-methyl-6-quinolin-6-ylpyrazin-2-yl)-5-phenyl-1,3,4-oxadiazole
SMILESCc1ncc(-c2ccc3ncccc3c2)nc1-c1nnc(-c2ccccc2)o1
InChIInChI=1S/C22H15N5O/c1-14-20(22-27-26-21(28-22)15-6-3-2-4-7-15)25-19(13-24-14)17-9-10-18-16(12-17)8-5-11-23-18/h2-13H,1H3
InChIKeyMSNOEJUHIXDYCZ-UHFFFAOYSA-N
XLogP4.72
TPSA77.59 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.40
LogP ≤ 54.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

1-[3-[5-methyl-6-(5-phenyl-1,3,4-oxadiazol-2-yl)pyrazin-2-yl]phenyl]ethanone;molecular hydrogen
CID 161223720
[3-[5-methyl-6-(5-phenyl-1,3,4-oxadiazol-2-yl)pyrazin-2-yl]phenyl]methanol
CID 159186622
2-[3-methyl-6-(3-methylsulfonylphenyl)pyrazin-2-yl]-5-phenyl-1,3,4-oxadiazole
CID 146735790
2-[3-methyl-6-(4-methylsulfonylphenyl)pyrazin-2-yl]-5-phenyl-1,3,4-oxadiazole;molecular hydrogen
CID 158428005
2-[6-(4-ethylsulfonylphenyl)-3-methylpyrazin-2-yl]-5-phenyl-1,3,4-oxadiazole
CID 152905324
2-[6-(2-bromophenyl)-3-methylpyrazin-2-yl]-5-phenyl-1,3,4-oxadiazole
CID 90763951
N-[4-[5-methyl-6-(5-phenyl-1,3,4-oxadiazol-2-yl)pyrazin-2-yl]phenyl]acetamide;molecular hydrogen
CID 161451115
N',N'-dimethyl-N-[4-[5-methyl-6-(5-phenyl-1,3,4-oxadiazol-2-yl)pyrazin-2-yl]-2-pyridinyl]ethane-1,2-diamine
CID 91184902
2-phenyl-5-quinolin-3-yl-1,3,4-oxadiazole
CID 142733340
4-[5-methyl-6-(5-phenyl-1,3,4-oxadiazol-2-yl)pyrazin-2-yl]pyridine-3-carbonitrile;molecular hydrogen
CID 160707259
5-quinolin-6-yl-1,3,4-oxadiazol-2-amine
CID 62850439
2-[3-methyl-6-(2-propylsulfanylphenyl)pyrazin-2-yl]-5-phenyl-1,3,4-oxadiazole
CID 157222447

Frequently Asked Questions

What is the IUPAC name of 2-(3-methyl-6-quinolin-6-ylpyrazin-2-yl)-5-phenyl-1,3,4-oxadiazole?
The IUPAC name of 2-(3-methyl-6-quinolin-6-ylpyrazin-2-yl)-5-phenyl-1,3,4-oxadiazole (CID 121399760) is 2-(3-methyl-6-quinolin-6-ylpyrazin-2-yl)-5-phenyl-1,3,4-oxadiazole.
What is the SMILES notation for 2-(3-methyl-6-quinolin-6-ylpyrazin-2-yl)-5-phenyl-1,3,4-oxadiazole?
The canonical SMILES for 2-(3-methyl-6-quinolin-6-ylpyrazin-2-yl)-5-phenyl-1,3,4-oxadiazole is Cc1ncc(-c2ccc3ncccc3c2)nc1-c1nnc(-c2ccccc2)o1.
What is the InChIKey of 2-(3-methyl-6-quinolin-6-ylpyrazin-2-yl)-5-phenyl-1,3,4-oxadiazole?
The InChIKey is MSNOEJUHIXDYCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H15N5O/c1-14-20(22-27-26-21(28-22)15-6-3-2-4-7-15)25-19(13-24-14)17-9-10-18-16(12-17)8-5-11-23-18/h2-13H,1H3.
What are the key properties of 2-(3-methyl-6-quinolin-6-ylpyrazin-2-yl)-5-phenyl-1,3,4-oxadiazole?
2-(3-methyl-6-quinolin-6-ylpyrazin-2-yl)-5-phenyl-1,3,4-oxadiazole has a molecular weight of 365.40 g/mol, XLogP of 4.72, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methyl-6-quinolin-6-ylpyrazin-2-yl)-5-phenyl-1,3,4-oxadiazole is sourced from PubChem (CID 121399760), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).