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

C18H13N5O — CID 175019956

IUPAC5-phenyl-3-(5-phenyl-1,2,4-oxadiazol-3-yl)pyrazin-2-amine
SMILESNc1ncc(-c2ccccc2)nc1-c1noc(-c2ccccc2)n1
InChIInChI=1S/C18H13N5O/c19-16-15(21-14(11-20-16)12-7-3-1-4-8-12)17-22-18(24-23-17)13-9-5-2-6-10-13/h1-11H,(H2,19,20)
InChIKeyRFMWXDWTHHMGCE-UHFFFAOYSA-N
MW315.34 g/mol
LogP3.44
Rot. Bonds3

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

5-phenyl-3-(5-phenyl-1,2,4-oxadiazol-3-yl)pyrazin-2-amine (PubChem CID 175019956) has the molecular formula C18H13N5O and a molecular weight of 315.34 g/mol. Its IUPAC name is 5-phenyl-3-(5-phenyl-1,2,4-oxadiazol-3-yl)pyrazin-2-amine.

Molecular Properties

Compound Name5-phenyl-3-(5-phenyl-1,2,4-oxadiazol-3-yl)pyrazin-2-amine
PubChem CID175019956
Molecular FormulaC18H13N5O
Molecular Weight315.34 g/mol
Exact Mass315.11
IUPAC Name5-phenyl-3-(5-phenyl-1,2,4-oxadiazol-3-yl)pyrazin-2-amine
SMILESNc1ncc(-c2ccccc2)nc1-c1noc(-c2ccccc2)n1
InChIInChI=1S/C18H13N5O/c19-16-15(21-14(11-20-16)12-7-3-1-4-8-12)17-22-18(24-23-17)13-9-5-2-6-10-13/h1-11H,(H2,19,20)
InChIKeyRFMWXDWTHHMGCE-UHFFFAOYSA-N
XLogP3.44
TPSA90.72 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.34
LogP ≤ 53.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 5-phenyl-3-(5-phenyl-1,2,4-oxadiazol-3-yl)pyrazin-2-amine?
The IUPAC name of 5-phenyl-3-(5-phenyl-1,2,4-oxadiazol-3-yl)pyrazin-2-amine (CID 175019956) is 5-phenyl-3-(5-phenyl-1,2,4-oxadiazol-3-yl)pyrazin-2-amine.
What is the SMILES notation for 5-phenyl-3-(5-phenyl-1,2,4-oxadiazol-3-yl)pyrazin-2-amine?
The canonical SMILES for 5-phenyl-3-(5-phenyl-1,2,4-oxadiazol-3-yl)pyrazin-2-amine is Nc1ncc(-c2ccccc2)nc1-c1noc(-c2ccccc2)n1.
What is the InChIKey of 5-phenyl-3-(5-phenyl-1,2,4-oxadiazol-3-yl)pyrazin-2-amine?
The InChIKey is RFMWXDWTHHMGCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H13N5O/c19-16-15(21-14(11-20-16)12-7-3-1-4-8-12)17-22-18(24-23-17)13-9-5-2-6-10-13/h1-11H,(H2,19,20).
What are the key properties of 5-phenyl-3-(5-phenyl-1,2,4-oxadiazol-3-yl)pyrazin-2-amine?
5-phenyl-3-(5-phenyl-1,2,4-oxadiazol-3-yl)pyrazin-2-amine has a molecular weight of 315.34 g/mol, XLogP of 3.44, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-phenyl-3-(5-phenyl-1,2,4-oxadiazol-3-yl)pyrazin-2-amine is sourced from PubChem (CID 175019956), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).