2-ethyl-5-methyl-3,6-bis(2-methylpropyl)pyrazine

C15H26N2 — CID 10681224

IUPAC2-ethyl-5-methyl-3,6-bis(2-methylpropyl)pyrazine
SMILESCCc1nc(CC(C)C)c(C)nc1CC(C)C
InChIInChI=1S/C15H26N2/c1-7-13-15(9-11(4)5)16-12(6)14(17-13)8-10(2)3/h10-11H,7-9H2,1-6H3
InChIKeyBXMRDEFHZMKCQH-UHFFFAOYSA-N
MW234.39 g/mol
LogP3.74
Rot. Bonds5

About 2-ethyl-5-methyl-3,6-bis(2-methylpropyl)pyrazine

2-ethyl-5-methyl-3,6-bis(2-methylpropyl)pyrazine (PubChem CID 10681224) has the molecular formula C15H26N2 and a molecular weight of 234.39 g/mol. Its IUPAC name is 2-ethyl-5-methyl-3,6-bis(2-methylpropyl)pyrazine.

Molecular Properties

Compound Name2-ethyl-5-methyl-3,6-bis(2-methylpropyl)pyrazine
PubChem CID10681224
Molecular FormulaC15H26N2
Molecular Weight234.39 g/mol
Exact Mass234.21
IUPAC Name2-ethyl-5-methyl-3,6-bis(2-methylpropyl)pyrazine
SMILESCCc1nc(CC(C)C)c(C)nc1CC(C)C
InChIInChI=1S/C15H26N2/c1-7-13-15(9-11(4)5)16-12(6)14(17-13)8-10(2)3/h10-11H,7-9H2,1-6H3
InChIKeyBXMRDEFHZMKCQH-UHFFFAOYSA-N
XLogP3.74
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.39
LogP ≤ 53.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 2-ethyl-5-methyl-3,6-bis(2-methylpropyl)pyrazine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-5-methyl-3,6-bis(2-methylpropyl)pyrazine?
The IUPAC name of 2-ethyl-5-methyl-3,6-bis(2-methylpropyl)pyrazine (CID 10681224) is 2-ethyl-5-methyl-3,6-bis(2-methylpropyl)pyrazine.
What is the SMILES notation for 2-ethyl-5-methyl-3,6-bis(2-methylpropyl)pyrazine?
The canonical SMILES for 2-ethyl-5-methyl-3,6-bis(2-methylpropyl)pyrazine is CCc1nc(CC(C)C)c(C)nc1CC(C)C.
What is the InChIKey of 2-ethyl-5-methyl-3,6-bis(2-methylpropyl)pyrazine?
The InChIKey is BXMRDEFHZMKCQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2/c1-7-13-15(9-11(4)5)16-12(6)14(17-13)8-10(2)3/h10-11H,7-9H2,1-6H3.
What are the key properties of 2-ethyl-5-methyl-3,6-bis(2-methylpropyl)pyrazine?
2-ethyl-5-methyl-3,6-bis(2-methylpropyl)pyrazine has a molecular weight of 234.39 g/mol, XLogP of 3.74, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-5-methyl-3,6-bis(2-methylpropyl)pyrazine is sourced from PubChem (CID 10681224), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).