5-tert-butyl-3-ethenyl-1,2-dihydropyrazine

C10H16N2 — CID 155371252

IUPAC5-tert-butyl-3-ethenyl-1,2-dihydropyrazine
SMILESC=CC1=NC(C(C)(C)C)=CNC1
InChIInChI=1S/C10H16N2/c1-5-8-6-11-7-9(12-8)10(2,3)4/h5,7,11H,1,6H2,2-4H3
InChIKeyONPKMBPWHLMQRN-UHFFFAOYSA-N
MW164.25 g/mol
LogP2.10
Rot. Bonds1

About 5-tert-butyl-3-ethenyl-1,2-dihydropyrazine

5-tert-butyl-3-ethenyl-1,2-dihydropyrazine (PubChem CID 155371252) has the molecular formula C10H16N2 and a molecular weight of 164.25 g/mol. Its IUPAC name is 5-tert-butyl-3-ethenyl-1,2-dihydropyrazine.

Molecular Properties

Compound Name5-tert-butyl-3-ethenyl-1,2-dihydropyrazine
PubChem CID155371252
Molecular FormulaC10H16N2
Molecular Weight164.25 g/mol
Exact Mass164.13
IUPAC Name5-tert-butyl-3-ethenyl-1,2-dihydropyrazine
SMILESC=CC1=NC(C(C)(C)C)=CNC1
InChIInChI=1S/C10H16N2/c1-5-8-6-11-7-9(12-8)10(2,3)4/h5,7,11H,1,6H2,2-4H3
InChIKeyONPKMBPWHLMQRN-UHFFFAOYSA-N
XLogP2.10
TPSA24.39 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.25
LogP ≤ 52.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-tert-butyl-3-ethenyl-1,2-dihydropyrazine?
The IUPAC name of 5-tert-butyl-3-ethenyl-1,2-dihydropyrazine (CID 155371252) is 5-tert-butyl-3-ethenyl-1,2-dihydropyrazine.
What is the SMILES notation for 5-tert-butyl-3-ethenyl-1,2-dihydropyrazine?
The canonical SMILES for 5-tert-butyl-3-ethenyl-1,2-dihydropyrazine is C=CC1=NC(C(C)(C)C)=CNC1.
What is the InChIKey of 5-tert-butyl-3-ethenyl-1,2-dihydropyrazine?
The InChIKey is ONPKMBPWHLMQRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2/c1-5-8-6-11-7-9(12-8)10(2,3)4/h5,7,11H,1,6H2,2-4H3.
What are the key properties of 5-tert-butyl-3-ethenyl-1,2-dihydropyrazine?
5-tert-butyl-3-ethenyl-1,2-dihydropyrazine has a molecular weight of 164.25 g/mol, XLogP of 2.10, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-tert-butyl-3-ethenyl-1,2-dihydropyrazine is sourced from PubChem (CID 155371252), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).