3-(2-piperazin-1-ylethylamino)pyrazine-2-carbonitrile

C11H16N6 — CID 62671831

IUPAC3-(2-piperazin-1-ylethylamino)pyrazine-2-carbonitrile
SMILESN#Cc1nccnc1NCCN1CCNCC1
InChIInChI=1S/C11H16N6/c12-9-10-11(15-2-1-14-10)16-5-8-17-6-3-13-4-7-17/h1-2,13H,3-8H2,(H,15,16)
InChIKeyRGYKWOQINGVLHQ-UHFFFAOYSA-N
MW232.29 g/mol
LogP-0.33
Rot. Bonds4

About 3-(2-piperazin-1-ylethylamino)pyrazine-2-carbonitrile

3-(2-piperazin-1-ylethylamino)pyrazine-2-carbonitrile (PubChem CID 62671831) has the molecular formula C11H16N6 and a molecular weight of 232.29 g/mol. Its IUPAC name is 3-(2-piperazin-1-ylethylamino)pyrazine-2-carbonitrile.

Molecular Properties

Compound Name3-(2-piperazin-1-ylethylamino)pyrazine-2-carbonitrile
PubChem CID62671831
Molecular FormulaC11H16N6
Molecular Weight232.29 g/mol
Exact Mass232.14
IUPAC Name3-(2-piperazin-1-ylethylamino)pyrazine-2-carbonitrile
SMILESN#Cc1nccnc1NCCN1CCNCC1
InChIInChI=1S/C11H16N6/c12-9-10-11(15-2-1-14-10)16-5-8-17-6-3-13-4-7-17/h1-2,13H,3-8H2,(H,15,16)
InChIKeyRGYKWOQINGVLHQ-UHFFFAOYSA-N
XLogP-0.33
TPSA76.87 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.29
LogP ≤ 5-0.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

3-[2-(4-acetylpiperazin-1-yl)ethylamino]pyrazine-2-carbonitrile
CID 133283160
1-methyl-3-(2-piperazin-1-ylethylamino)pyrazin-2-one
CID 62938349
3-[2-(methylamino)ethylamino]pyrazine-2-carbonitrile
CID 62674136
3-(2-piperidin-3-ylethylamino)pyrazine-2-carbonitrile
CID 55247646
3-(2-methoxyethylamino)pyrazine-2-carbonitrile
CID 62671434
N-(2-piperazin-1-ylethyl)-1,3-thiazol-2-amine
CID 43600406
5-fluoro-6-methyl-N-(2-piperazin-1-ylethyl)pyrimidin-4-amine
CID 114045681
3,5-dichloro-N-(2-piperazin-1-ylethyl)pyridin-2-amine
CID 43600403
3-(octylamino)pyrazine-2-carbonitrile
CID 115568129
3-[(1,4-dimethylpiperidin-4-yl)methylamino]pyrazine-2-carbonitrile
CID 113362481
3-[2-(cyclohexen-1-yl)ethylamino]pyrazine-2-carbonitrile
CID 55110800
3-amino-2-(2-thiomorpholin-4-ylethylamino)pyridine-4-carbonitrile
CID 114173737

Frequently Asked Questions

What is the IUPAC name of 3-(2-piperazin-1-ylethylamino)pyrazine-2-carbonitrile?
The IUPAC name of 3-(2-piperazin-1-ylethylamino)pyrazine-2-carbonitrile (CID 62671831) is 3-(2-piperazin-1-ylethylamino)pyrazine-2-carbonitrile.
What is the SMILES notation for 3-(2-piperazin-1-ylethylamino)pyrazine-2-carbonitrile?
The canonical SMILES for 3-(2-piperazin-1-ylethylamino)pyrazine-2-carbonitrile is N#Cc1nccnc1NCCN1CCNCC1.
What is the InChIKey of 3-(2-piperazin-1-ylethylamino)pyrazine-2-carbonitrile?
The InChIKey is RGYKWOQINGVLHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N6/c12-9-10-11(15-2-1-14-10)16-5-8-17-6-3-13-4-7-17/h1-2,13H,3-8H2,(H,15,16).
What are the key properties of 3-(2-piperazin-1-ylethylamino)pyrazine-2-carbonitrile?
3-(2-piperazin-1-ylethylamino)pyrazine-2-carbonitrile has a molecular weight of 232.29 g/mol, XLogP of -0.33, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-piperazin-1-ylethylamino)pyrazine-2-carbonitrile is sourced from PubChem (CID 62671831), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).