2-ethyl-5-imidazol-1-ylpyrazine

C9H10N4 — CID 59059029

IUPAC2-ethyl-5-imidazol-1-ylpyrazine
SMILESCCc1cnc(-n2ccnc2)cn1
InChIInChI=1S/C9H10N4/c1-2-8-5-12-9(6-11-8)13-4-3-10-7-13/h3-7H,2H2,1H3
InChIKeyXRMJCCSXLASMSF-UHFFFAOYSA-N
MW174.21 g/mol
LogP1.22
Rot. Bonds2

About 2-ethyl-5-imidazol-1-ylpyrazine

2-ethyl-5-imidazol-1-ylpyrazine (PubChem CID 59059029) has the molecular formula C9H10N4 and a molecular weight of 174.21 g/mol. Its IUPAC name is 2-ethyl-5-imidazol-1-ylpyrazine.

Molecular Properties

Compound Name2-ethyl-5-imidazol-1-ylpyrazine
PubChem CID59059029
Molecular FormulaC9H10N4
Molecular Weight174.21 g/mol
Exact Mass174.09
IUPAC Name2-ethyl-5-imidazol-1-ylpyrazine
SMILESCCc1cnc(-n2ccnc2)cn1
InChIInChI=1S/C9H10N4/c1-2-8-5-12-9(6-11-8)13-4-3-10-7-13/h3-7H,2H2,1H3
InChIKeyXRMJCCSXLASMSF-UHFFFAOYSA-N
XLogP1.22
TPSA43.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500174.21
LogP ≤ 51.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-ethyl-5-imidazol-1-ylpyrazine?
The IUPAC name of 2-ethyl-5-imidazol-1-ylpyrazine (CID 59059029) is 2-ethyl-5-imidazol-1-ylpyrazine.
What is the SMILES notation for 2-ethyl-5-imidazol-1-ylpyrazine?
The canonical SMILES for 2-ethyl-5-imidazol-1-ylpyrazine is CCc1cnc(-n2ccnc2)cn1.
What is the InChIKey of 2-ethyl-5-imidazol-1-ylpyrazine?
The InChIKey is XRMJCCSXLASMSF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N4/c1-2-8-5-12-9(6-11-8)13-4-3-10-7-13/h3-7H,2H2,1H3.
What are the key properties of 2-ethyl-5-imidazol-1-ylpyrazine?
2-ethyl-5-imidazol-1-ylpyrazine has a molecular weight of 174.21 g/mol, XLogP of 1.22, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-5-imidazol-1-ylpyrazine is sourced from PubChem (CID 59059029), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).