2-(2-ethylimidazol-1-yl)-6-pyrrolidin-2-ylpyrazine

C13H17N5 — CID 110246161

IUPAC2-(2-ethylimidazol-1-yl)-6-pyrrolidin-2-ylpyrazine
SMILESCCc1nccn1-c1cncc(C2CCCN2)n1
InChIInChI=1S/C13H17N5/c1-2-12-16-6-7-18(12)13-9-14-8-11(17-13)10-4-3-5-15-10/h6-10,15H,2-5H2,1H3
InChIKeyWCXJHQBSUIPWCO-UHFFFAOYSA-N
MW243.31 g/mol
LogP1.65
Rot. Bonds3

About 2-(2-ethylimidazol-1-yl)-6-pyrrolidin-2-ylpyrazine

2-(2-ethylimidazol-1-yl)-6-pyrrolidin-2-ylpyrazine (PubChem CID 110246161) has the molecular formula C13H17N5 and a molecular weight of 243.31 g/mol. Its IUPAC name is 2-(2-ethylimidazol-1-yl)-6-pyrrolidin-2-ylpyrazine.

Molecular Properties

Compound Name2-(2-ethylimidazol-1-yl)-6-pyrrolidin-2-ylpyrazine
PubChem CID110246161
Molecular FormulaC13H17N5
Molecular Weight243.31 g/mol
Exact Mass243.15
IUPAC Name2-(2-ethylimidazol-1-yl)-6-pyrrolidin-2-ylpyrazine
SMILESCCc1nccn1-c1cncc(C2CCCN2)n1
InChIInChI=1S/C13H17N5/c1-2-12-16-6-7-18(12)13-9-14-8-11(17-13)10-4-3-5-15-10/h6-10,15H,2-5H2,1H3
InChIKeyWCXJHQBSUIPWCO-UHFFFAOYSA-N
XLogP1.65
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.31
LogP ≤ 51.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(2-ethylimidazol-1-yl)-6-pyrrolidin-2-ylpyrazine?
The IUPAC name of 2-(2-ethylimidazol-1-yl)-6-pyrrolidin-2-ylpyrazine (CID 110246161) is 2-(2-ethylimidazol-1-yl)-6-pyrrolidin-2-ylpyrazine.
What is the SMILES notation for 2-(2-ethylimidazol-1-yl)-6-pyrrolidin-2-ylpyrazine?
The canonical SMILES for 2-(2-ethylimidazol-1-yl)-6-pyrrolidin-2-ylpyrazine is CCc1nccn1-c1cncc(C2CCCN2)n1.
What is the InChIKey of 2-(2-ethylimidazol-1-yl)-6-pyrrolidin-2-ylpyrazine?
The InChIKey is WCXJHQBSUIPWCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N5/c1-2-12-16-6-7-18(12)13-9-14-8-11(17-13)10-4-3-5-15-10/h6-10,15H,2-5H2,1H3.
What are the key properties of 2-(2-ethylimidazol-1-yl)-6-pyrrolidin-2-ylpyrazine?
2-(2-ethylimidazol-1-yl)-6-pyrrolidin-2-ylpyrazine has a molecular weight of 243.31 g/mol, XLogP of 1.65, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-ethylimidazol-1-yl)-6-pyrrolidin-2-ylpyrazine is sourced from PubChem (CID 110246161), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).