1,3-diethyl-2H-pyrazine

C8H14N2 — CID 150747593

IUPAC1,3-diethyl-2H-pyrazine
SMILESCCC1=NC=CN(CC)C1
InChIInChI=1S/C8H14N2/c1-3-8-7-10(4-2)6-5-9-8/h5-6H,3-4,7H2,1-2H3
InChIKeyJVEJWEBMBCMUFY-UHFFFAOYSA-N
MW138.21 g/mol
LogP1.64
Rot. Bonds2

About 1,3-diethyl-2H-pyrazine

1,3-diethyl-2H-pyrazine (PubChem CID 150747593) has the molecular formula C8H14N2 and a molecular weight of 138.21 g/mol. Its IUPAC name is 1,3-diethyl-2H-pyrazine.

Molecular Properties

Compound Name1,3-diethyl-2H-pyrazine
PubChem CID150747593
Molecular FormulaC8H14N2
Molecular Weight138.21 g/mol
Exact Mass138.12
IUPAC Name1,3-diethyl-2H-pyrazine
SMILESCCC1=NC=CN(CC)C1
InChIInChI=1S/C8H14N2/c1-3-8-7-10(4-2)6-5-9-8/h5-6H,3-4,7H2,1-2H3
InChIKeyJVEJWEBMBCMUFY-UHFFFAOYSA-N
XLogP1.64
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500138.21
LogP ≤ 51.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 1,3-diethyl-2H-pyrazine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1,3-diethyl-2H-pyrazine?
The IUPAC name of 1,3-diethyl-2H-pyrazine (CID 150747593) is 1,3-diethyl-2H-pyrazine.
What is the SMILES notation for 1,3-diethyl-2H-pyrazine?
The canonical SMILES for 1,3-diethyl-2H-pyrazine is CCC1=NC=CN(CC)C1.
What is the InChIKey of 1,3-diethyl-2H-pyrazine?
The InChIKey is JVEJWEBMBCMUFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14N2/c1-3-8-7-10(4-2)6-5-9-8/h5-6H,3-4,7H2,1-2H3.
What are the key properties of 1,3-diethyl-2H-pyrazine?
1,3-diethyl-2H-pyrazine has a molecular weight of 138.21 g/mol, XLogP of 1.64, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-diethyl-2H-pyrazine is sourced from PubChem (CID 150747593), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).