2,5-dimethyl-3,6-bis(2-methylpropyl)pyrazine

C14H24N2 — CID 585410

IUPAC2,5-dimethyl-3,6-bis(2-methylpropyl)pyrazine
SMILESCc1nc(CC(C)C)c(C)nc1CC(C)C
InChIInChI=1S/C14H24N2/c1-9(2)7-13-11(5)16-14(8-10(3)4)12(6)15-13/h9-10H,7-8H2,1-6H3
InChIKeyQFPSKYGXQMHPCZ-UHFFFAOYSA-N
MW220.36 g/mol
LogP3.49
Rot. Bonds4

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

2,5-dimethyl-3,6-bis(2-methylpropyl)pyrazine (PubChem CID 585410) has the molecular formula C14H24N2 and a molecular weight of 220.36 g/mol. Its IUPAC name is 2,5-dimethyl-3,6-bis(2-methylpropyl)pyrazine.

Molecular Properties

Compound Name2,5-dimethyl-3,6-bis(2-methylpropyl)pyrazine
PubChem CID585410
Molecular FormulaC14H24N2
Molecular Weight220.36 g/mol
Exact Mass220.19
IUPAC Name2,5-dimethyl-3,6-bis(2-methylpropyl)pyrazine
SMILESCc1nc(CC(C)C)c(C)nc1CC(C)C
InChIInChI=1S/C14H24N2/c1-9(2)7-13-11(5)16-14(8-10(3)4)12(6)15-13/h9-10H,7-8H2,1-6H3
InChIKeyQFPSKYGXQMHPCZ-UHFFFAOYSA-N
XLogP3.49
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.36
LogP ≤ 53.49
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-bis(2-methylpropyl)pyrazine?
The IUPAC name of 2,5-dimethyl-3,6-bis(2-methylpropyl)pyrazine (CID 585410) is 2,5-dimethyl-3,6-bis(2-methylpropyl)pyrazine.
What is the SMILES notation for 2,5-dimethyl-3,6-bis(2-methylpropyl)pyrazine?
The canonical SMILES for 2,5-dimethyl-3,6-bis(2-methylpropyl)pyrazine is Cc1nc(CC(C)C)c(C)nc1CC(C)C.
What is the InChIKey of 2,5-dimethyl-3,6-bis(2-methylpropyl)pyrazine?
The InChIKey is QFPSKYGXQMHPCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2/c1-9(2)7-13-11(5)16-14(8-10(3)4)12(6)15-13/h9-10H,7-8H2,1-6H3.
What are the key properties of 2,5-dimethyl-3,6-bis(2-methylpropyl)pyrazine?
2,5-dimethyl-3,6-bis(2-methylpropyl)pyrazine has a molecular weight of 220.36 g/mol, XLogP of 3.49, 4 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-bis(2-methylpropyl)pyrazine is sourced from PubChem (CID 585410), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).