6-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]pyrazin-2-amine

C12H22N6 — CID 80647233

IUPAC6-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]pyrazin-2-amine
SMILESCN(C)CCN1CCN(c2cncc(N)n2)CC1
InChIInChI=1S/C12H22N6/c1-16(2)3-4-17-5-7-18(8-6-17)12-10-14-9-11(13)15-12/h9-10H,3-8H2,1-2H3,(H2,13,15)
InChIKeyAPWRNKFLVFMCBM-UHFFFAOYSA-N
MW250.35 g/mol
LogP-0.26
Rot. Bonds4

About 6-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]pyrazin-2-amine

6-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]pyrazin-2-amine (PubChem CID 80647233) has the molecular formula C12H22N6 and a molecular weight of 250.35 g/mol. Its IUPAC name is 6-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]pyrazin-2-amine.

Molecular Properties

Compound Name6-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]pyrazin-2-amine
PubChem CID80647233
Molecular FormulaC12H22N6
Molecular Weight250.35 g/mol
Exact Mass250.19
IUPAC Name6-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]pyrazin-2-amine
SMILESCN(C)CCN1CCN(c2cncc(N)n2)CC1
InChIInChI=1S/C12H22N6/c1-16(2)3-4-17-5-7-18(8-6-17)12-10-14-9-11(13)15-12/h9-10H,3-8H2,1-2H3,(H2,13,15)
InChIKeyAPWRNKFLVFMCBM-UHFFFAOYSA-N
XLogP-0.26
TPSA61.52 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.35
LogP ≤ 5-0.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 6-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]pyrazin-2-amine?
The IUPAC name of 6-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]pyrazin-2-amine (CID 80647233) is 6-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]pyrazin-2-amine.
What is the SMILES notation for 6-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]pyrazin-2-amine?
The canonical SMILES for 6-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]pyrazin-2-amine is CN(C)CCN1CCN(c2cncc(N)n2)CC1.
What is the InChIKey of 6-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]pyrazin-2-amine?
The InChIKey is APWRNKFLVFMCBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N6/c1-16(2)3-4-17-5-7-18(8-6-17)12-10-14-9-11(13)15-12/h9-10H,3-8H2,1-2H3,(H2,13,15).
What are the key properties of 6-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]pyrazin-2-amine?
6-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]pyrazin-2-amine has a molecular weight of 250.35 g/mol, XLogP of -0.26, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]pyrazin-2-amine is sourced from PubChem (CID 80647233), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).