2,3,5-trimethylpyrazine

C14H20N4 — CID 18993807

IUPAC2,3,5-trimethylpyrazine
SMILESCc1cnc(C)c(C)n1.Cc1cnc(C)c(C)n1
InChIInChI=1S/2C7H10N2/c2*1-5-4-8-6(2)7(3)9-5/h2*4H,1-3H3
InChIKeyCIVXBSXGXHPWFT-UHFFFAOYSA-N
MW244.34 g/mol
LogP2.80
Rot. Bonds

About 2,3,5-trimethylpyrazine

2,3,5-trimethylpyrazine (PubChem CID 18993807) has the molecular formula C14H20N4 and a molecular weight of 244.34 g/mol. Its IUPAC name is 2,3,5-trimethylpyrazine.

Molecular Properties

Compound Name2,3,5-trimethylpyrazine
PubChem CID18993807
Molecular FormulaC14H20N4
Molecular Weight244.34 g/mol
Exact Mass244.17
IUPAC Name2,3,5-trimethylpyrazine
SMILESCc1cnc(C)c(C)n1.Cc1cnc(C)c(C)n1
InChIInChI=1S/2C7H10N2/c2*1-5-4-8-6(2)7(3)9-5/h2*4H,1-3H3
InChIKeyCIVXBSXGXHPWFT-UHFFFAOYSA-N
XLogP2.80
TPSA51.56 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.34
LogP ≤ 52.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 2,3,5-trimethylpyrazine with MolForge

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

Launch Full Analysis

Related Compounds

2,5-Dimethylpyrazine
CID 31252
2,6-Dimethylpyrazine
CID 7938
Trimethylpyrazine
CID 26808
2-Methylpyrazine
CID 7976
2,3-Dimethylpyrazine
CID 22201
5-Ethyl-2,3-dimethylpyrazine
CID 27460
2-Ethyl-5(or6)-methylpyrazine
CID 16220105
Pyrazine, 2,2'-dithiodimethylenedi-
CID 24844153
2-Methyl-5-(tributylstannyl)pyrazine
CID 59693794
3-Ethynyl-2,5-dimethylpyrazine
CID 13081757
1,2,5-Trimethylpyrazin-1-ium iodide
CID 13514258
2-Ethyl-3,5-dimethyl-pyrazine
CID 16220104

Frequently Asked Questions

What is the IUPAC name of 2,3,5-trimethylpyrazine?
The IUPAC name of 2,3,5-trimethylpyrazine (CID 18993807) is 2,3,5-trimethylpyrazine.
What is the SMILES notation for 2,3,5-trimethylpyrazine?
The canonical SMILES for 2,3,5-trimethylpyrazine is Cc1cnc(C)c(C)n1.Cc1cnc(C)c(C)n1.
What is the InChIKey of 2,3,5-trimethylpyrazine?
The InChIKey is CIVXBSXGXHPWFT-UHFFFAOYSA-N. The full InChI is InChI=1S/2C7H10N2/c2*1-5-4-8-6(2)7(3)9-5/h2*4H,1-3H3.
What are the key properties of 2,3,5-trimethylpyrazine?
2,3,5-trimethylpyrazine has a molecular weight of 244.34 g/mol, XLogP of 2.80, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3,5-trimethylpyrazine is sourced from PubChem (CID 18993807), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).