N'-(2-piperazin-1-ylethyl)pyrazine-2-carboximidamide

C11H18N6 — CID 71569069

IUPACN'-(2-piperazin-1-ylethyl)pyrazine-2-carboximidamide
SMILESN/C(=N\CCN1CCNCC1)c1cnccn1
InChIInChI=1S/C11H18N6/c12-11(10-9-14-1-2-15-10)16-5-8-17-6-3-13-4-7-17/h1-2,9,13H,3-8H2,(H2,12,16)
InChIKeyPJMDGDKPFKUAFY-UHFFFAOYSA-N
MW234.31 g/mol
LogP-0.91
Rot. Bonds4

About N'-(2-piperazin-1-ylethyl)pyrazine-2-carboximidamide

N'-(2-piperazin-1-ylethyl)pyrazine-2-carboximidamide (PubChem CID 71569069) has the molecular formula C11H18N6 and a molecular weight of 234.31 g/mol. Its IUPAC name is N'-(2-piperazin-1-ylethyl)pyrazine-2-carboximidamide.

Molecular Properties

Compound NameN'-(2-piperazin-1-ylethyl)pyrazine-2-carboximidamide
PubChem CID71569069
Molecular FormulaC11H18N6
Molecular Weight234.31 g/mol
Exact Mass234.16
IUPAC NameN'-(2-piperazin-1-ylethyl)pyrazine-2-carboximidamide
SMILESN/C(=N\CCN1CCNCC1)c1cnccn1
InChIInChI=1S/C11H18N6/c12-11(10-9-14-1-2-15-10)16-5-8-17-6-3-13-4-7-17/h1-2,9,13H,3-8H2,(H2,12,16)
InChIKeyPJMDGDKPFKUAFY-UHFFFAOYSA-N
XLogP-0.91
TPSA79.43 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.31
LogP ≤ 5-0.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Related Compounds

2-(4,5-dihydro-1H-imidazol-2-yl)pyrazine
CID 12843664
Pyrazine-2-carboxamidine hydrochloride
CID 470895
N'-(2-morpholin-4-ylethyl)pyrazine-2-carboximidamide
CID 71568915
N'-[3-[4-[3-[[amino(pyrazin-2-yl)methylidene]amino]propyl]piperazin-1-yl]propyl]pyrazine-2-carboximidamide
CID 71569229
2-((Piperazin-1-yl)methyl)pyrazine
CID 43439447
N'-[4-[[amino(pyrazin-2-yl)methylidene]amino]butyl]pyrazine-2-carboximidamide
CID 71569072
Pyrazine-2-carboximidamide
CID 470896
N'-aminopyrazine-2-carboximidamide
CID 2800188
2-[(Piperazin-1-yl)methyl]pyrazine trihydrochloride
CID 126805766
N'-[(Z)-[amino(pyrazin-2-yl)methylene]amino]pyrazine-2-carboxamidine
CID 15494148
Pyrazine-2-carboximidohydrazide
CID 9583164
N'-methylpyrazine-2-carboximidamide
CID 63182040

Frequently Asked Questions

What is the IUPAC name of N'-(2-piperazin-1-ylethyl)pyrazine-2-carboximidamide?
The IUPAC name of N'-(2-piperazin-1-ylethyl)pyrazine-2-carboximidamide (CID 71569069) is N'-(2-piperazin-1-ylethyl)pyrazine-2-carboximidamide.
What is the SMILES notation for N'-(2-piperazin-1-ylethyl)pyrazine-2-carboximidamide?
The canonical SMILES for N'-(2-piperazin-1-ylethyl)pyrazine-2-carboximidamide is N/C(=N\CCN1CCNCC1)c1cnccn1.
What is the InChIKey of N'-(2-piperazin-1-ylethyl)pyrazine-2-carboximidamide?
The InChIKey is PJMDGDKPFKUAFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N6/c12-11(10-9-14-1-2-15-10)16-5-8-17-6-3-13-4-7-17/h1-2,9,13H,3-8H2,(H2,12,16).
What are the key properties of N'-(2-piperazin-1-ylethyl)pyrazine-2-carboximidamide?
N'-(2-piperazin-1-ylethyl)pyrazine-2-carboximidamide has a molecular weight of 234.31 g/mol, XLogP of -0.91, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(2-piperazin-1-ylethyl)pyrazine-2-carboximidamide is sourced from PubChem (CID 71569069), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).