3-(5-phenyl-1,3,4-oxadiazol-2-yl)-5-(2-phenylphenyl)pyrazin-2-amine

C24H17N5O — CID 59471915

IUPAC3-(5-phenyl-1,3,4-oxadiazol-2-yl)-5-(2-phenylphenyl)pyrazin-2-amine
SMILESNc1ncc(-c2ccccc2-c2ccccc2)nc1-c1nnc(-c2ccccc2)o1
InChIInChI=1S/C24H17N5O/c25-22-21(24-29-28-23(30-24)17-11-5-2-6-12-17)27-20(15-26-22)19-14-8-7-13-18(19)16-9-3-1-4-10-16/h1-15H,(H2,25,26)
InChIKeyATQTZSLFRXGNQI-UHFFFAOYSA-N
MW391.43 g/mol
LogP5.11
Rot. Bonds4

About 3-(5-phenyl-1,3,4-oxadiazol-2-yl)-5-(2-phenylphenyl)pyrazin-2-amine

3-(5-phenyl-1,3,4-oxadiazol-2-yl)-5-(2-phenylphenyl)pyrazin-2-amine (PubChem CID 59471915) has the molecular formula C24H17N5O and a molecular weight of 391.43 g/mol. Its IUPAC name is 3-(5-phenyl-1,3,4-oxadiazol-2-yl)-5-(2-phenylphenyl)pyrazin-2-amine.

Molecular Properties

Compound Name3-(5-phenyl-1,3,4-oxadiazol-2-yl)-5-(2-phenylphenyl)pyrazin-2-amine
PubChem CID59471915
Molecular FormulaC24H17N5O
Molecular Weight391.43 g/mol
Exact Mass391.14
IUPAC Name3-(5-phenyl-1,3,4-oxadiazol-2-yl)-5-(2-phenylphenyl)pyrazin-2-amine
SMILESNc1ncc(-c2ccccc2-c2ccccc2)nc1-c1nnc(-c2ccccc2)o1
InChIInChI=1S/C24H17N5O/c25-22-21(24-29-28-23(30-24)17-11-5-2-6-12-17)27-20(15-26-22)19-14-8-7-13-18(19)16-9-3-1-4-10-16/h1-15H,(H2,25,26)
InChIKeyATQTZSLFRXGNQI-UHFFFAOYSA-N
XLogP5.11
TPSA90.72 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500391.43
LogP ≤ 55.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 3-(5-phenyl-1,3,4-oxadiazol-2-yl)-5-(2-phenylphenyl)pyrazin-2-amine?
The IUPAC name of 3-(5-phenyl-1,3,4-oxadiazol-2-yl)-5-(2-phenylphenyl)pyrazin-2-amine (CID 59471915) is 3-(5-phenyl-1,3,4-oxadiazol-2-yl)-5-(2-phenylphenyl)pyrazin-2-amine.
What is the SMILES notation for 3-(5-phenyl-1,3,4-oxadiazol-2-yl)-5-(2-phenylphenyl)pyrazin-2-amine?
The canonical SMILES for 3-(5-phenyl-1,3,4-oxadiazol-2-yl)-5-(2-phenylphenyl)pyrazin-2-amine is Nc1ncc(-c2ccccc2-c2ccccc2)nc1-c1nnc(-c2ccccc2)o1.
What is the InChIKey of 3-(5-phenyl-1,3,4-oxadiazol-2-yl)-5-(2-phenylphenyl)pyrazin-2-amine?
The InChIKey is ATQTZSLFRXGNQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H17N5O/c25-22-21(24-29-28-23(30-24)17-11-5-2-6-12-17)27-20(15-26-22)19-14-8-7-13-18(19)16-9-3-1-4-10-16/h1-15H,(H2,25,26).
What are the key properties of 3-(5-phenyl-1,3,4-oxadiazol-2-yl)-5-(2-phenylphenyl)pyrazin-2-amine?
3-(5-phenyl-1,3,4-oxadiazol-2-yl)-5-(2-phenylphenyl)pyrazin-2-amine has a molecular weight of 391.43 g/mol, XLogP of 5.11, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(5-phenyl-1,3,4-oxadiazol-2-yl)-5-(2-phenylphenyl)pyrazin-2-amine is sourced from PubChem (CID 59471915), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).