6-chloro-N-(2-piperazin-1-ylethyl)pyrazin-2-amine

C10H16ClN5 — CID 116650770

IUPAC6-chloro-N-(2-piperazin-1-ylethyl)pyrazin-2-amine
SMILESClc1cncc(NCCN2CCNCC2)n1
InChIInChI=1S/C10H16ClN5/c11-9-7-13-8-10(15-9)14-3-6-16-4-1-12-2-5-16/h7-8,12H,1-6H2,(H,14,15)
InChIKeyOYKNJUOXLVWPSG-UHFFFAOYSA-N
MW241.73 g/mol
LogP0.45
Rot. Bonds4

About 6-chloro-N-(2-piperazin-1-ylethyl)pyrazin-2-amine

6-chloro-N-(2-piperazin-1-ylethyl)pyrazin-2-amine (PubChem CID 116650770) has the molecular formula C10H16ClN5 and a molecular weight of 241.73 g/mol. Its IUPAC name is 6-chloro-N-(2-piperazin-1-ylethyl)pyrazin-2-amine.

Molecular Properties

Compound Name6-chloro-N-(2-piperazin-1-ylethyl)pyrazin-2-amine
PubChem CID116650770
Molecular FormulaC10H16ClN5
Molecular Weight241.73 g/mol
Exact Mass241.11
IUPAC Name6-chloro-N-(2-piperazin-1-ylethyl)pyrazin-2-amine
SMILESClc1cncc(NCCN2CCNCC2)n1
InChIInChI=1S/C10H16ClN5/c11-9-7-13-8-10(15-9)14-3-6-16-4-1-12-2-5-16/h7-8,12H,1-6H2,(H,14,15)
InChIKeyOYKNJUOXLVWPSG-UHFFFAOYSA-N
XLogP0.45
TPSA53.08 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.73
LogP ≤ 50.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-chloro-N-(2-piperazin-1-ylethyl)pyrazin-2-amine?
The IUPAC name of 6-chloro-N-(2-piperazin-1-ylethyl)pyrazin-2-amine (CID 116650770) is 6-chloro-N-(2-piperazin-1-ylethyl)pyrazin-2-amine.
What is the SMILES notation for 6-chloro-N-(2-piperazin-1-ylethyl)pyrazin-2-amine?
The canonical SMILES for 6-chloro-N-(2-piperazin-1-ylethyl)pyrazin-2-amine is Clc1cncc(NCCN2CCNCC2)n1.
What is the InChIKey of 6-chloro-N-(2-piperazin-1-ylethyl)pyrazin-2-amine?
The InChIKey is OYKNJUOXLVWPSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16ClN5/c11-9-7-13-8-10(15-9)14-3-6-16-4-1-12-2-5-16/h7-8,12H,1-6H2,(H,14,15).
What are the key properties of 6-chloro-N-(2-piperazin-1-ylethyl)pyrazin-2-amine?
6-chloro-N-(2-piperazin-1-ylethyl)pyrazin-2-amine has a molecular weight of 241.73 g/mol, XLogP of 0.45, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-N-(2-piperazin-1-ylethyl)pyrazin-2-amine is sourced from PubChem (CID 116650770), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).