2-(4-imidazol-1-ylpiperidin-1-yl)pyrazine

C12H15N5 — CID 133301086

IUPAC2-(4-imidazol-1-ylpiperidin-1-yl)pyrazine
SMILESc1cnc(N2CCC(n3ccnc3)CC2)cn1
InChIInChI=1S/C12H15N5/c1-6-16(12-9-13-3-4-15-12)7-2-11(1)17-8-5-14-10-17/h3-5,8-11H,1-2,6-7H2
InChIKeyHNZCFXOAMOKTKL-UHFFFAOYSA-N
MW229.29 g/mol
LogP1.51
Rot. Bonds2

About 2-(4-imidazol-1-ylpiperidin-1-yl)pyrazine

2-(4-imidazol-1-ylpiperidin-1-yl)pyrazine (PubChem CID 133301086) has the molecular formula C12H15N5 and a molecular weight of 229.29 g/mol. Its IUPAC name is 2-(4-imidazol-1-ylpiperidin-1-yl)pyrazine.

Molecular Properties

Compound Name2-(4-imidazol-1-ylpiperidin-1-yl)pyrazine
PubChem CID133301086
Molecular FormulaC12H15N5
Molecular Weight229.29 g/mol
Exact Mass229.13
IUPAC Name2-(4-imidazol-1-ylpiperidin-1-yl)pyrazine
SMILESc1cnc(N2CCC(n3ccnc3)CC2)cn1
InChIInChI=1S/C12H15N5/c1-6-16(12-9-13-3-4-15-12)7-2-11(1)17-8-5-14-10-17/h3-5,8-11H,1-2,6-7H2
InChIKeyHNZCFXOAMOKTKL-UHFFFAOYSA-N
XLogP1.51
TPSA46.84 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.29
LogP ≤ 51.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(4-imidazol-1-ylpiperidin-1-yl)pyrazine?
The IUPAC name of 2-(4-imidazol-1-ylpiperidin-1-yl)pyrazine (CID 133301086) is 2-(4-imidazol-1-ylpiperidin-1-yl)pyrazine.
What is the SMILES notation for 2-(4-imidazol-1-ylpiperidin-1-yl)pyrazine?
The canonical SMILES for 2-(4-imidazol-1-ylpiperidin-1-yl)pyrazine is c1cnc(N2CCC(n3ccnc3)CC2)cn1.
What is the InChIKey of 2-(4-imidazol-1-ylpiperidin-1-yl)pyrazine?
The InChIKey is HNZCFXOAMOKTKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N5/c1-6-16(12-9-13-3-4-15-12)7-2-11(1)17-8-5-14-10-17/h3-5,8-11H,1-2,6-7H2.
What are the key properties of 2-(4-imidazol-1-ylpiperidin-1-yl)pyrazine?
2-(4-imidazol-1-ylpiperidin-1-yl)pyrazine has a molecular weight of 229.29 g/mol, XLogP of 1.51, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-imidazol-1-ylpiperidin-1-yl)pyrazine is sourced from PubChem (CID 133301086), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).