2-[4-(3-methylpyrazin-2-yl)piperazin-1-yl]ethanamine

C11H19N5 — CID 83063868

IUPAC2-[4-(3-methylpyrazin-2-yl)piperazin-1-yl]ethanamine
SMILESCc1nccnc1N1CCN(CCN)CC1
InChIInChI=1S/C11H19N5/c1-10-11(14-4-3-13-10)16-8-6-15(5-2-12)7-9-16/h3-4H,2,5-9,12H2,1H3
InChIKeyHNXWQABKTBZQMC-UHFFFAOYSA-N
MW221.31 g/mol
LogP-0.13
Rot. Bonds3

About 2-[4-(3-methylpyrazin-2-yl)piperazin-1-yl]ethanamine

2-[4-(3-methylpyrazin-2-yl)piperazin-1-yl]ethanamine (PubChem CID 83063868) has the molecular formula C11H19N5 and a molecular weight of 221.31 g/mol. Its IUPAC name is 2-[4-(3-methylpyrazin-2-yl)piperazin-1-yl]ethanamine.

Molecular Properties

Compound Name2-[4-(3-methylpyrazin-2-yl)piperazin-1-yl]ethanamine
PubChem CID83063868
Molecular FormulaC11H19N5
Molecular Weight221.31 g/mol
Exact Mass221.16
IUPAC Name2-[4-(3-methylpyrazin-2-yl)piperazin-1-yl]ethanamine
SMILESCc1nccnc1N1CCN(CCN)CC1
InChIInChI=1S/C11H19N5/c1-10-11(14-4-3-13-10)16-8-6-15(5-2-12)7-9-16/h3-4H,2,5-9,12H2,1H3
InChIKeyHNXWQABKTBZQMC-UHFFFAOYSA-N
XLogP-0.13
TPSA58.28 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.31
LogP ≤ 5-0.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-[4-(3-methylpyrazin-2-yl)piperazin-1-yl]ethanamine?
The IUPAC name of 2-[4-(3-methylpyrazin-2-yl)piperazin-1-yl]ethanamine (CID 83063868) is 2-[4-(3-methylpyrazin-2-yl)piperazin-1-yl]ethanamine.
What is the SMILES notation for 2-[4-(3-methylpyrazin-2-yl)piperazin-1-yl]ethanamine?
The canonical SMILES for 2-[4-(3-methylpyrazin-2-yl)piperazin-1-yl]ethanamine is Cc1nccnc1N1CCN(CCN)CC1.
What is the InChIKey of 2-[4-(3-methylpyrazin-2-yl)piperazin-1-yl]ethanamine?
The InChIKey is HNXWQABKTBZQMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N5/c1-10-11(14-4-3-13-10)16-8-6-15(5-2-12)7-9-16/h3-4H,2,5-9,12H2,1H3.
What are the key properties of 2-[4-(3-methylpyrazin-2-yl)piperazin-1-yl]ethanamine?
2-[4-(3-methylpyrazin-2-yl)piperazin-1-yl]ethanamine has a molecular weight of 221.31 g/mol, XLogP of -0.13, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(3-methylpyrazin-2-yl)piperazin-1-yl]ethanamine is sourced from PubChem (CID 83063868), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).