2-[4-(pyrazin-2-ylmethyl)piperidin-1-yl]pyrazine

C14H17N5 — CID 95840908

IUPAC2-[4-(pyrazin-2-ylmethyl)piperidin-1-yl]pyrazine
SMILESc1cnc(CC2CCN(c3cnccn3)CC2)cn1
InChIInChI=1S/C14H17N5/c1-7-19(14-11-16-4-6-18-14)8-2-12(1)9-13-10-15-3-5-17-13/h3-6,10-12H,1-2,7-9H2
InChIKeyIEFQKTGDEUFGNA-UHFFFAOYSA-N
MW255.32 g/mol
LogP1.73
Rot. Bonds3

About 2-[4-(pyrazin-2-ylmethyl)piperidin-1-yl]pyrazine

2-[4-(pyrazin-2-ylmethyl)piperidin-1-yl]pyrazine (PubChem CID 95840908) has the molecular formula C14H17N5 and a molecular weight of 255.32 g/mol. Its IUPAC name is 2-[4-(pyrazin-2-ylmethyl)piperidin-1-yl]pyrazine.

Molecular Properties

Compound Name2-[4-(pyrazin-2-ylmethyl)piperidin-1-yl]pyrazine
PubChem CID95840908
Molecular FormulaC14H17N5
Molecular Weight255.32 g/mol
Exact Mass255.15
IUPAC Name2-[4-(pyrazin-2-ylmethyl)piperidin-1-yl]pyrazine
SMILESc1cnc(CC2CCN(c3cnccn3)CC2)cn1
InChIInChI=1S/C14H17N5/c1-7-19(14-11-16-4-6-18-14)8-2-12(1)9-13-10-15-3-5-17-13/h3-6,10-12H,1-2,7-9H2
InChIKeyIEFQKTGDEUFGNA-UHFFFAOYSA-N
XLogP1.73
TPSA54.80 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.32
LogP ≤ 51.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-[4-(pyrazin-2-ylmethyl)piperidin-1-yl]pyrazine?
The IUPAC name of 2-[4-(pyrazin-2-ylmethyl)piperidin-1-yl]pyrazine (CID 95840908) is 2-[4-(pyrazin-2-ylmethyl)piperidin-1-yl]pyrazine.
What is the SMILES notation for 2-[4-(pyrazin-2-ylmethyl)piperidin-1-yl]pyrazine?
The canonical SMILES for 2-[4-(pyrazin-2-ylmethyl)piperidin-1-yl]pyrazine is c1cnc(CC2CCN(c3cnccn3)CC2)cn1.
What is the InChIKey of 2-[4-(pyrazin-2-ylmethyl)piperidin-1-yl]pyrazine?
The InChIKey is IEFQKTGDEUFGNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N5/c1-7-19(14-11-16-4-6-18-14)8-2-12(1)9-13-10-15-3-5-17-13/h3-6,10-12H,1-2,7-9H2.
What are the key properties of 2-[4-(pyrazin-2-ylmethyl)piperidin-1-yl]pyrazine?
2-[4-(pyrazin-2-ylmethyl)piperidin-1-yl]pyrazine has a molecular weight of 255.32 g/mol, XLogP of 1.73, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(pyrazin-2-ylmethyl)piperidin-1-yl]pyrazine is sourced from PubChem (CID 95840908), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).