2-(4-iodopiperazin-1-yl)pyrazine

C8H11IN4 — CID 143021662

IUPAC2-(4-iodopiperazin-1-yl)pyrazine
SMILESIN1CCN(c2cnccn2)CC1
InChIInChI=1S/C8H11IN4/c9-13-5-3-12(4-6-13)8-7-10-1-2-11-8/h1-2,7H,3-6H2
InChIKeyJHRFBVWQTBJXQA-UHFFFAOYSA-N
MW290.11 g/mol
LogP0.95
Rot. Bonds1

About 2-(4-iodopiperazin-1-yl)pyrazine

2-(4-iodopiperazin-1-yl)pyrazine (PubChem CID 143021662) has the molecular formula C8H11IN4 and a molecular weight of 290.11 g/mol. Its IUPAC name is 2-(4-iodopiperazin-1-yl)pyrazine.

Molecular Properties

Compound Name2-(4-iodopiperazin-1-yl)pyrazine
PubChem CID143021662
Molecular FormulaC8H11IN4
Molecular Weight290.11 g/mol
Exact Mass290.00
IUPAC Name2-(4-iodopiperazin-1-yl)pyrazine
SMILESIN1CCN(c2cnccn2)CC1
InChIInChI=1S/C8H11IN4/c9-13-5-3-12(4-6-13)8-7-10-1-2-11-8/h1-2,7H,3-6H2
InChIKeyJHRFBVWQTBJXQA-UHFFFAOYSA-N
XLogP0.95
TPSA32.26 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.11
LogP ≤ 50.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'iodine', 'substructure': 'N/A'}, {'alert_name': 'N-halo', 'substructure': 'N/A'}

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Related Compounds

4-pyrazin-2-ylthiomorpholine
CID 131156249
2-(4-methylsulfanylpiperazin-1-yl)pyrazine
CID 142028272
1-pyrazin-2-ylpiperidin-4-one
CID 14156398
3-piperidin-1-yl-6-(4-pyrazin-2-ylpiperazin-1-yl)pyridazine
CID 171700804
ethane;4-pyrazin-2-ylmorpholine
CID 143018931
2-(4-bromopiperidin-1-yl)pyrazine
CID 80674882
4-(4-pyrazin-2-ylpiperazin-1-yl)phenol
CID 4795412
2-(4-pyrazin-2-ylpiperazin-1-yl)phenol
CID 2572823
2-methyl-4-(4-pyrazin-2-ylpiperazin-1-yl)-6-pyrrolidin-1-ylpyrimidine
CID 154853788
2-[4-(bromomethylsulfonyl)piperazin-1-yl]pyrazine
CID 83092433
2-[4-(4-methoxyphenyl)piperazin-1-yl]pyrazine
CID 4780942
1-(4-pyrazin-2-ylpiperazin-1-yl)propan-1-one
CID 60715497

Frequently Asked Questions

What is the IUPAC name of 2-(4-iodopiperazin-1-yl)pyrazine?
The IUPAC name of 2-(4-iodopiperazin-1-yl)pyrazine (CID 143021662) is 2-(4-iodopiperazin-1-yl)pyrazine.
What is the SMILES notation for 2-(4-iodopiperazin-1-yl)pyrazine?
The canonical SMILES for 2-(4-iodopiperazin-1-yl)pyrazine is IN1CCN(c2cnccn2)CC1.
What is the InChIKey of 2-(4-iodopiperazin-1-yl)pyrazine?
The InChIKey is JHRFBVWQTBJXQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11IN4/c9-13-5-3-12(4-6-13)8-7-10-1-2-11-8/h1-2,7H,3-6H2.
What are the key properties of 2-(4-iodopiperazin-1-yl)pyrazine?
2-(4-iodopiperazin-1-yl)pyrazine has a molecular weight of 290.11 g/mol, XLogP of 0.95, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-iodopiperazin-1-yl)pyrazine is sourced from PubChem (CID 143021662), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).