2-(4-propan-2-ylpiperazin-1-yl)-5-[5-(4-propan-2-ylpiperazin-1-yl)pyrazin-2-yl]pyrazine

C22H34N8 — CID 58006688

IUPAC2-(4-propan-2-ylpiperazin-1-yl)-5-[5-(4-propan-2-ylpiperazin-1-yl)pyrazin-2-yl]pyrazine
SMILESCC(C)N1CCN(c2cnc(-c3cnc(N4CCN(C(C)C)CC4)cn3)cn2)CC1
InChIInChI=1S/C22H34N8/c1-17(2)27-5-9-29(10-6-27)21-15-23-19(13-25-21)20-14-26-22(16-24-20)30-11-7-28(8-12-30)18(3)4/h13-18H,5-12H2,1-4H3
InChIKeyQBTQUVASPATVBO-UHFFFAOYSA-N
MW410.57 g/mol
LogP1.99
Rot. Bonds5

About 2-(4-propan-2-ylpiperazin-1-yl)-5-[5-(4-propan-2-ylpiperazin-1-yl)pyrazin-2-yl]pyrazine

2-(4-propan-2-ylpiperazin-1-yl)-5-[5-(4-propan-2-ylpiperazin-1-yl)pyrazin-2-yl]pyrazine (PubChem CID 58006688) has the molecular formula C22H34N8 and a molecular weight of 410.57 g/mol. Its IUPAC name is 2-(4-propan-2-ylpiperazin-1-yl)-5-[5-(4-propan-2-ylpiperazin-1-yl)pyrazin-2-yl]pyrazine.

Molecular Properties

Compound Name2-(4-propan-2-ylpiperazin-1-yl)-5-[5-(4-propan-2-ylpiperazin-1-yl)pyrazin-2-yl]pyrazine
PubChem CID58006688
Molecular FormulaC22H34N8
Molecular Weight410.57 g/mol
Exact Mass410.29
IUPAC Name2-(4-propan-2-ylpiperazin-1-yl)-5-[5-(4-propan-2-ylpiperazin-1-yl)pyrazin-2-yl]pyrazine
SMILESCC(C)N1CCN(c2cnc(-c3cnc(N4CCN(C(C)C)CC4)cn3)cn2)CC1
InChIInChI=1S/C22H34N8/c1-17(2)27-5-9-29(10-6-27)21-15-23-19(13-25-21)20-14-26-22(16-24-20)30-11-7-28(8-12-30)18(3)4/h13-18H,5-12H2,1-4H3
InChIKeyQBTQUVASPATVBO-UHFFFAOYSA-N
XLogP1.99
TPSA64.52 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds5
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500410.57
LogP ≤ 51.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

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Frequently Asked Questions

What is the IUPAC name of 2-(4-propan-2-ylpiperazin-1-yl)-5-[5-(4-propan-2-ylpiperazin-1-yl)pyrazin-2-yl]pyrazine?
The IUPAC name of 2-(4-propan-2-ylpiperazin-1-yl)-5-[5-(4-propan-2-ylpiperazin-1-yl)pyrazin-2-yl]pyrazine (CID 58006688) is 2-(4-propan-2-ylpiperazin-1-yl)-5-[5-(4-propan-2-ylpiperazin-1-yl)pyrazin-2-yl]pyrazine.
What is the SMILES notation for 2-(4-propan-2-ylpiperazin-1-yl)-5-[5-(4-propan-2-ylpiperazin-1-yl)pyrazin-2-yl]pyrazine?
The canonical SMILES for 2-(4-propan-2-ylpiperazin-1-yl)-5-[5-(4-propan-2-ylpiperazin-1-yl)pyrazin-2-yl]pyrazine is CC(C)N1CCN(c2cnc(-c3cnc(N4CCN(C(C)C)CC4)cn3)cn2)CC1.
What is the InChIKey of 2-(4-propan-2-ylpiperazin-1-yl)-5-[5-(4-propan-2-ylpiperazin-1-yl)pyrazin-2-yl]pyrazine?
The InChIKey is QBTQUVASPATVBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H34N8/c1-17(2)27-5-9-29(10-6-27)21-15-23-19(13-25-21)20-14-26-22(16-24-20)30-11-7-28(8-12-30)18(3)4/h13-18H,5-12H2,1-4H3.
What are the key properties of 2-(4-propan-2-ylpiperazin-1-yl)-5-[5-(4-propan-2-ylpiperazin-1-yl)pyrazin-2-yl]pyrazine?
2-(4-propan-2-ylpiperazin-1-yl)-5-[5-(4-propan-2-ylpiperazin-1-yl)pyrazin-2-yl]pyrazine has a molecular weight of 410.57 g/mol, XLogP of 1.99, 5 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-propan-2-ylpiperazin-1-yl)-5-[5-(4-propan-2-ylpiperazin-1-yl)pyrazin-2-yl]pyrazine is sourced from PubChem (CID 58006688), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).