2-tert-butyl-6-(3-tert-butylphenyl)pyrazine

C18H24N2 — CID 134411024

IUPAC2-tert-butyl-6-(3-tert-butylphenyl)pyrazine
SMILESCC(C)(C)c1cccc(-c2cncc(C(C)(C)C)n2)c1
InChIInChI=1S/C18H24N2/c1-17(2,3)14-9-7-8-13(10-14)15-11-19-12-16(20-15)18(4,5)6/h7-12H,1-6H3
InChIKeyAXFQDDIVYPIUGP-UHFFFAOYSA-N
MW268.40 g/mol
LogP4.74
Rot. Bonds1

About 2-tert-butyl-6-(3-tert-butylphenyl)pyrazine

2-tert-butyl-6-(3-tert-butylphenyl)pyrazine (PubChem CID 134411024) has the molecular formula C18H24N2 and a molecular weight of 268.40 g/mol. Its IUPAC name is 2-tert-butyl-6-(3-tert-butylphenyl)pyrazine.

Molecular Properties

Compound Name2-tert-butyl-6-(3-tert-butylphenyl)pyrazine
PubChem CID134411024
Molecular FormulaC18H24N2
Molecular Weight268.40 g/mol
Exact Mass268.19
IUPAC Name2-tert-butyl-6-(3-tert-butylphenyl)pyrazine
SMILESCC(C)(C)c1cccc(-c2cncc(C(C)(C)C)n2)c1
InChIInChI=1S/C18H24N2/c1-17(2,3)14-9-7-8-13(10-14)15-11-19-12-16(20-15)18(4,5)6/h7-12H,1-6H3
InChIKeyAXFQDDIVYPIUGP-UHFFFAOYSA-N
XLogP4.74
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.40
LogP ≤ 54.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-tert-butyl-6-[3-(3-methylbutan-2-yl)phenyl]pyrazine
CID 134415035
2-tert-butyl-5-(3-tert-butylphenyl)pyridine
CID 90148532
1-tert-butyl-3-(3-tert-butylphenyl)benzene;ethane
CID 159548907
2-tert-butyl-6-(2-fluorophenyl)pyrazine
CID 135179551
3-[6-(4-methylphenyl)pyrazin-2-yl]aniline
CID 126474004
2-(3-tert-butylphenyl)-5-(trifluoromethyl)pyridine
CID 58432818
2,4-bis(3-tert-butylphenyl)-6-methyl-1,3,5-triazine
CID 168805959
2-[3-[4,6-bis[3-(3,5-ditert-butylphenyl)phenyl]-2-pyridinyl]phenyl]pyrazine
CID 164834142
1,2-bis(3-tert-butylphenyl)benzene
CID 164767999
1-tert-butyl-3-(4-tert-butylphenyl)benzene
CID 12682933
2-tert-butyl-4,6-diphenylpyrimidine;4-tert-butyl-2,6-diphenylpyrimidine;2-(3-tert-butylphenyl)-4,6-diphenylpyrimidine;2-(4-tert-butylphenyl)-4,6-diphenylpyrimidine;4-(4-tert-butylphenyl)-2,6-diphenylpyrimidine
CID 160500413
4-tert-butyl-2-phenyl-6-(3-phenylphenyl)pyrimidine
CID 155790859

Frequently Asked Questions

What is the IUPAC name of 2-tert-butyl-6-(3-tert-butylphenyl)pyrazine?
The IUPAC name of 2-tert-butyl-6-(3-tert-butylphenyl)pyrazine (CID 134411024) is 2-tert-butyl-6-(3-tert-butylphenyl)pyrazine.
What is the SMILES notation for 2-tert-butyl-6-(3-tert-butylphenyl)pyrazine?
The canonical SMILES for 2-tert-butyl-6-(3-tert-butylphenyl)pyrazine is CC(C)(C)c1cccc(-c2cncc(C(C)(C)C)n2)c1.
What is the InChIKey of 2-tert-butyl-6-(3-tert-butylphenyl)pyrazine?
The InChIKey is AXFQDDIVYPIUGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2/c1-17(2,3)14-9-7-8-13(10-14)15-11-19-12-16(20-15)18(4,5)6/h7-12H,1-6H3.
What are the key properties of 2-tert-butyl-6-(3-tert-butylphenyl)pyrazine?
2-tert-butyl-6-(3-tert-butylphenyl)pyrazine has a molecular weight of 268.40 g/mol, XLogP of 4.74, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-tert-butyl-6-(3-tert-butylphenyl)pyrazine is sourced from PubChem (CID 134411024), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).