3-pyrazin-2-yl-5-quinolin-8-yl-1,2,4-oxadiazole

C15H9N5O — CID 97014533

IUPAC3-pyrazin-2-yl-5-quinolin-8-yl-1,2,4-oxadiazole
SMILESc1cnc2c(-c3nc(-c4cnccn4)no3)cccc2c1
InChIInChI=1S/C15H9N5O/c1-3-10-4-2-6-18-13(10)11(5-1)15-19-14(20-21-15)12-9-16-7-8-17-12/h1-9H
InChIKeyKLFRZRJBDLIIBX-UHFFFAOYSA-N
MW275.27 g/mol
LogP2.74
Rot. Bonds2

About 3-pyrazin-2-yl-5-quinolin-8-yl-1,2,4-oxadiazole

3-pyrazin-2-yl-5-quinolin-8-yl-1,2,4-oxadiazole (PubChem CID 97014533) has the molecular formula C15H9N5O and a molecular weight of 275.27 g/mol. Its IUPAC name is 3-pyrazin-2-yl-5-quinolin-8-yl-1,2,4-oxadiazole.

Molecular Properties

Compound Name3-pyrazin-2-yl-5-quinolin-8-yl-1,2,4-oxadiazole
PubChem CID97014533
Molecular FormulaC15H9N5O
Molecular Weight275.27 g/mol
Exact Mass275.08
IUPAC Name3-pyrazin-2-yl-5-quinolin-8-yl-1,2,4-oxadiazole
SMILESc1cnc2c(-c3nc(-c4cnccn4)no3)cccc2c1
InChIInChI=1S/C15H9N5O/c1-3-10-4-2-6-18-13(10)11(5-1)15-19-14(20-21-15)12-9-16-7-8-17-12/h1-9H
InChIKeyKLFRZRJBDLIIBX-UHFFFAOYSA-N
XLogP2.74
TPSA77.59 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.27
LogP ≤ 52.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

5-(1H-indol-4-yl)-3-pyrazin-2-yl-1,2,4-oxadiazole
CID 94069309
3-pyridin-2-yl-5-quinoxalin-5-yl-1,2,4-oxadiazole
CID 39819329
5-(3,3-dimethyl-2H-1-benzofuran-7-yl)-3-pyrazin-2-yl-1,2,4-oxadiazole
CID 138043127
1-(5-quinolin-8-yl-1,2,4-oxadiazol-3-yl)ethanol
CID 102660591
8-pyridin-2-ylquinoline
CID 10982041
3-(5-quinolin-8-yl-1,2,4-oxadiazol-3-yl)morpholine
CID 103971488
6-quinolin-8-ylpyrazin-2-amine
CID 81221904
8-(6-chloropyrazin-2-yl)quinoline
CID 77230241
3-quinolin-8-yl-4-[2-(3-quinolin-8-yl-1,2,4-oxadiazol-5-yl)phenyl]-1,2,4-oxadiazol-5-one
CID 146644700
3-[(3-pyrazin-2-yl-1,2,4-oxadiazol-5-yl)methyl]phenol
CID 63845058
1-(5-quinolin-8-yl-1,2,4-oxadiazol-3-yl)butan-2-amine
CID 62876085
5-(2-bromophenyl)-3-pyridin-2-yl-1,2,4-oxadiazole
CID 750612

Frequently Asked Questions

What is the IUPAC name of 3-pyrazin-2-yl-5-quinolin-8-yl-1,2,4-oxadiazole?
The IUPAC name of 3-pyrazin-2-yl-5-quinolin-8-yl-1,2,4-oxadiazole (CID 97014533) is 3-pyrazin-2-yl-5-quinolin-8-yl-1,2,4-oxadiazole.
What is the SMILES notation for 3-pyrazin-2-yl-5-quinolin-8-yl-1,2,4-oxadiazole?
The canonical SMILES for 3-pyrazin-2-yl-5-quinolin-8-yl-1,2,4-oxadiazole is c1cnc2c(-c3nc(-c4cnccn4)no3)cccc2c1.
What is the InChIKey of 3-pyrazin-2-yl-5-quinolin-8-yl-1,2,4-oxadiazole?
The InChIKey is KLFRZRJBDLIIBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H9N5O/c1-3-10-4-2-6-18-13(10)11(5-1)15-19-14(20-21-15)12-9-16-7-8-17-12/h1-9H.
What are the key properties of 3-pyrazin-2-yl-5-quinolin-8-yl-1,2,4-oxadiazole?
3-pyrazin-2-yl-5-quinolin-8-yl-1,2,4-oxadiazole has a molecular weight of 275.27 g/mol, XLogP of 2.74, 2 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-pyrazin-2-yl-5-quinolin-8-yl-1,2,4-oxadiazole is sourced from PubChem (CID 97014533), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).