2-methyl-5-(2-methylpropyl)-3,6-di(propan-2-yl)pyrazine

C15H26N2 — CID 10489901

IUPAC2-methyl-5-(2-methylpropyl)-3,6-di(propan-2-yl)pyrazine
SMILESCc1nc(C(C)C)c(CC(C)C)nc1C(C)C
InChIInChI=1S/C15H26N2/c1-9(2)8-13-15(11(5)6)16-12(7)14(17-13)10(3)4/h9-11H,8H2,1-7H3
InChIKeyVTRDVIDCTMAGET-UHFFFAOYSA-N
MW234.39 g/mol
LogP4.23
Rot. Bonds4

About 2-methyl-5-(2-methylpropyl)-3,6-di(propan-2-yl)pyrazine

2-methyl-5-(2-methylpropyl)-3,6-di(propan-2-yl)pyrazine (PubChem CID 10489901) has the molecular formula C15H26N2 and a molecular weight of 234.39 g/mol. Its IUPAC name is 2-methyl-5-(2-methylpropyl)-3,6-di(propan-2-yl)pyrazine.

Molecular Properties

Compound Name2-methyl-5-(2-methylpropyl)-3,6-di(propan-2-yl)pyrazine
PubChem CID10489901
Molecular FormulaC15H26N2
Molecular Weight234.39 g/mol
Exact Mass234.21
IUPAC Name2-methyl-5-(2-methylpropyl)-3,6-di(propan-2-yl)pyrazine
SMILESCc1nc(C(C)C)c(CC(C)C)nc1C(C)C
InChIInChI=1S/C15H26N2/c1-9(2)8-13-15(11(5)6)16-12(7)14(17-13)10(3)4/h9-11H,8H2,1-7H3
InChIKeyVTRDVIDCTMAGET-UHFFFAOYSA-N
XLogP4.23
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.39
LogP ≤ 54.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-5-(2-methylpropyl)-3,6-di(propan-2-yl)pyrazine?
The IUPAC name of 2-methyl-5-(2-methylpropyl)-3,6-di(propan-2-yl)pyrazine (CID 10489901) is 2-methyl-5-(2-methylpropyl)-3,6-di(propan-2-yl)pyrazine.
What is the SMILES notation for 2-methyl-5-(2-methylpropyl)-3,6-di(propan-2-yl)pyrazine?
The canonical SMILES for 2-methyl-5-(2-methylpropyl)-3,6-di(propan-2-yl)pyrazine is Cc1nc(C(C)C)c(CC(C)C)nc1C(C)C.
What is the InChIKey of 2-methyl-5-(2-methylpropyl)-3,6-di(propan-2-yl)pyrazine?
The InChIKey is VTRDVIDCTMAGET-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2/c1-9(2)8-13-15(11(5)6)16-12(7)14(17-13)10(3)4/h9-11H,8H2,1-7H3.
What are the key properties of 2-methyl-5-(2-methylpropyl)-3,6-di(propan-2-yl)pyrazine?
2-methyl-5-(2-methylpropyl)-3,6-di(propan-2-yl)pyrazine has a molecular weight of 234.39 g/mol, XLogP of 4.23, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-5-(2-methylpropyl)-3,6-di(propan-2-yl)pyrazine is sourced from PubChem (CID 10489901), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).