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

C12H20N2 — CID 13320992

IUPAC2,5-dimethyl-3,6-di(propan-2-yl)pyrazine
SMILESCc1nc(C(C)C)c(C)nc1C(C)C
InChIInChI=1S/C12H20N2/c1-7(2)11-9(5)14-12(8(3)4)10(6)13-11/h7-8H,1-6H3
InChIKeyJXTZDCLXNAWYRS-UHFFFAOYSA-N
MW192.31 g/mol
LogP3.34
Rot. Bonds2

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

2,5-dimethyl-3,6-di(propan-2-yl)pyrazine (PubChem CID 13320992) has the molecular formula C12H20N2 and a molecular weight of 192.31 g/mol. Its IUPAC name is 2,5-dimethyl-3,6-di(propan-2-yl)pyrazine.

Molecular Properties

Compound Name2,5-dimethyl-3,6-di(propan-2-yl)pyrazine
PubChem CID13320992
Molecular FormulaC12H20N2
Molecular Weight192.31 g/mol
Exact Mass192.16
IUPAC Name2,5-dimethyl-3,6-di(propan-2-yl)pyrazine
SMILESCc1nc(C(C)C)c(C)nc1C(C)C
InChIInChI=1S/C12H20N2/c1-7(2)11-9(5)14-12(8(3)4)10(6)13-11/h7-8H,1-6H3
InChIKeyJXTZDCLXNAWYRS-UHFFFAOYSA-N
XLogP3.34
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.31
LogP ≤ 53.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,5-dimethyl-3,6-di(propan-2-yl)pyrazine?
The IUPAC name of 2,5-dimethyl-3,6-di(propan-2-yl)pyrazine (CID 13320992) is 2,5-dimethyl-3,6-di(propan-2-yl)pyrazine.
What is the SMILES notation for 2,5-dimethyl-3,6-di(propan-2-yl)pyrazine?
The canonical SMILES for 2,5-dimethyl-3,6-di(propan-2-yl)pyrazine is Cc1nc(C(C)C)c(C)nc1C(C)C.
What is the InChIKey of 2,5-dimethyl-3,6-di(propan-2-yl)pyrazine?
The InChIKey is JXTZDCLXNAWYRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2/c1-7(2)11-9(5)14-12(8(3)4)10(6)13-11/h7-8H,1-6H3.
What are the key properties of 2,5-dimethyl-3,6-di(propan-2-yl)pyrazine?
2,5-dimethyl-3,6-di(propan-2-yl)pyrazine has a molecular weight of 192.31 g/mol, XLogP of 3.34, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dimethyl-3,6-di(propan-2-yl)pyrazine is sourced from PubChem (CID 13320992), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).