1,4-dimethylpyrazine;ethane

C8H16N2 — CID 91030282

IUPAC1,4-dimethylpyrazine;ethane
SMILESCC.CN1C=CN(C)C=C1
InChIInChI=1S/C6H10N2.C2H6/c1-7-3-5-8(2)6-4-7;1-2/h3-6H,1-2H3;1-2H3
InChIKeySBDPCSALHABGTD-UHFFFAOYSA-N
MW140.23 g/mol
LogP1.83
Rot. Bonds

About 1,4-dimethylpyrazine;ethane

1,4-dimethylpyrazine;ethane (PubChem CID 91030282) has the molecular formula C8H16N2 and a molecular weight of 140.23 g/mol. Its IUPAC name is 1,4-dimethylpyrazine;ethane.

Molecular Properties

Compound Name1,4-dimethylpyrazine;ethane
PubChem CID91030282
Molecular FormulaC8H16N2
Molecular Weight140.23 g/mol
Exact Mass140.13
IUPAC Name1,4-dimethylpyrazine;ethane
SMILESCC.CN1C=CN(C)C=C1
InChIInChI=1S/C6H10N2.C2H6/c1-7-3-5-8(2)6-4-7;1-2/h3-6H,1-2H3;1-2H3
InChIKeySBDPCSALHABGTD-UHFFFAOYSA-N
XLogP1.83
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.23
LogP ≤ 51.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1,4-dimethylpyrazine;ethane?
The IUPAC name of 1,4-dimethylpyrazine;ethane (CID 91030282) is 1,4-dimethylpyrazine;ethane.
What is the SMILES notation for 1,4-dimethylpyrazine;ethane?
The canonical SMILES for 1,4-dimethylpyrazine;ethane is CC.CN1C=CN(C)C=C1.
What is the InChIKey of 1,4-dimethylpyrazine;ethane?
The InChIKey is SBDPCSALHABGTD-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N2.C2H6/c1-7-3-5-8(2)6-4-7;1-2/h3-6H,1-2H3;1-2H3.
What are the key properties of 1,4-dimethylpyrazine;ethane?
1,4-dimethylpyrazine;ethane has a molecular weight of 140.23 g/mol, XLogP of 1.83, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,4-dimethylpyrazine;ethane is sourced from PubChem (CID 91030282), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).