2,5-dimethyl-1,4-dihydropyrazine

C6H10N2 — CID 15413126

IUPAC2,5-dimethyl-1,4-dihydropyrazine
SMILESCC1=CNC(C)=CN1
InChIInChI=1S/C6H10N2/c1-5-3-8-6(2)4-7-5/h3-4,7-8H,1-2H3
InChIKeyREXJTOPNZGHGJZ-UHFFFAOYSA-N
MW110.16 g/mol
LogP0.90
Rot. Bonds

About 2,5-dimethyl-1,4-dihydropyrazine

2,5-dimethyl-1,4-dihydropyrazine (PubChem CID 15413126) has the molecular formula C6H10N2 and a molecular weight of 110.16 g/mol. Its IUPAC name is 2,5-dimethyl-1,4-dihydropyrazine.

Molecular Properties

Compound Name2,5-dimethyl-1,4-dihydropyrazine
PubChem CID15413126
Molecular FormulaC6H10N2
Molecular Weight110.16 g/mol
Exact Mass110.08
IUPAC Name2,5-dimethyl-1,4-dihydropyrazine
SMILESCC1=CNC(C)=CN1
InChIInChI=1S/C6H10N2/c1-5-3-8-6(2)4-7-5/h3-4,7-8H,1-2H3
InChIKeyREXJTOPNZGHGJZ-UHFFFAOYSA-N
XLogP0.90
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms8
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500110.16
LogP ≤ 50.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,5-dimethyl-1,4-dihydropyrazine?
The IUPAC name of 2,5-dimethyl-1,4-dihydropyrazine (CID 15413126) is 2,5-dimethyl-1,4-dihydropyrazine.
What is the SMILES notation for 2,5-dimethyl-1,4-dihydropyrazine?
The canonical SMILES for 2,5-dimethyl-1,4-dihydropyrazine is CC1=CNC(C)=CN1.
What is the InChIKey of 2,5-dimethyl-1,4-dihydropyrazine?
The InChIKey is REXJTOPNZGHGJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N2/c1-5-3-8-6(2)4-7-5/h3-4,7-8H,1-2H3.
What are the key properties of 2,5-dimethyl-1,4-dihydropyrazine?
2,5-dimethyl-1,4-dihydropyrazine has a molecular weight of 110.16 g/mol, XLogP of 0.90, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dimethyl-1,4-dihydropyrazine is sourced from PubChem (CID 15413126), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).