2-imidazol-1-yl-6-piperidin-4-ylpyrazine

C12H15N5 — CID 95804707

IUPAC2-imidazol-1-yl-6-piperidin-4-ylpyrazine
SMILESc1cn(-c2cncc(C3CCNCC3)n2)cn1
InChIInChI=1S/C12H15N5/c1-3-13-4-2-10(1)11-7-15-8-12(16-11)17-6-5-14-9-17/h5-10,13H,1-4H2
InChIKeyMZJVCFVYUOHKNB-UHFFFAOYSA-N
MW229.29 g/mol
LogP1.13
Rot. Bonds2

About 2-imidazol-1-yl-6-piperidin-4-ylpyrazine

2-imidazol-1-yl-6-piperidin-4-ylpyrazine (PubChem CID 95804707) has the molecular formula C12H15N5 and a molecular weight of 229.29 g/mol. Its IUPAC name is 2-imidazol-1-yl-6-piperidin-4-ylpyrazine.

Molecular Properties

Compound Name2-imidazol-1-yl-6-piperidin-4-ylpyrazine
PubChem CID95804707
Molecular FormulaC12H15N5
Molecular Weight229.29 g/mol
Exact Mass229.13
IUPAC Name2-imidazol-1-yl-6-piperidin-4-ylpyrazine
SMILESc1cn(-c2cncc(C3CCNCC3)n2)cn1
InChIInChI=1S/C12H15N5/c1-3-13-4-2-10(1)11-7-15-8-12(16-11)17-6-5-14-9-17/h5-10,13H,1-4H2
InChIKeyMZJVCFVYUOHKNB-UHFFFAOYSA-N
XLogP1.13
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.29
LogP ≤ 51.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-imidazol-1-yl-6-piperidin-4-ylpyrazine?
The IUPAC name of 2-imidazol-1-yl-6-piperidin-4-ylpyrazine (CID 95804707) is 2-imidazol-1-yl-6-piperidin-4-ylpyrazine.
What is the SMILES notation for 2-imidazol-1-yl-6-piperidin-4-ylpyrazine?
The canonical SMILES for 2-imidazol-1-yl-6-piperidin-4-ylpyrazine is c1cn(-c2cncc(C3CCNCC3)n2)cn1.
What is the InChIKey of 2-imidazol-1-yl-6-piperidin-4-ylpyrazine?
The InChIKey is MZJVCFVYUOHKNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N5/c1-3-13-4-2-10(1)11-7-15-8-12(16-11)17-6-5-14-9-17/h5-10,13H,1-4H2.
What are the key properties of 2-imidazol-1-yl-6-piperidin-4-ylpyrazine?
2-imidazol-1-yl-6-piperidin-4-ylpyrazine has a molecular weight of 229.29 g/mol, XLogP of 1.13, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-imidazol-1-yl-6-piperidin-4-ylpyrazine is sourced from PubChem (CID 95804707), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).