N'-[(Z)-2-aminoethenyl]piperazine-1-carboximidamide

C₇H₁₅N₅ — CID 155722729

About N'-[(Z)-2-aminoethenyl]piperazine-1-carboximidamide

N'-[(Z)-2-aminoethenyl]piperazine-1-carboximidamide (PubChem CID 155722729) has the molecular formula C₇H₁₅N₅ and a molecular weight of 169.23 g/mol. Its IUPAC name is N'-[(Z)-2-aminoethenyl]piperazine-1-carboximidamide.

Molecular Properties

• Compound Name: N'-[(Z)-2-aminoethenyl]piperazine-1-carboximidamide
• PubChem CID: 155722729
• Molecular Formula: C₇H₁₅N₅
• Molecular Weight: 169.23 g/mol
• Exact Mass: 169.13
• IUPAC Name: N'-[(Z)-2-aminoethenyl]piperazine-1-carboximidamide
• SMILES: N/C=C\N=C(/N)N1CCNCC1
• InChI: InChI=1S/C7H15N5/c8-1-2-11-7(9)12-5-3-10-4-6-12/h1-2,10H,3-6,8H2,(H2,9,11)/b2-1-
• InChIKey: RSSLYKGDRMUVKG-UPHRSURJSA-N
• XLogP: -1.36
• TPSA: 79.67 Ų
• H-Bond Donors: 3
• H-Bond Acceptors: 3
• Rotatable Bonds: 1
• Heavy Atoms: 12
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	169.23
LogP ≤ 5	-1.36
H-Bond Donors ≤ 5	3
H-Bond Acceptors ≤ 10	3

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of N'-[(Z)-2-aminoethenyl]piperazine-1-carboximidamide?

The IUPAC name of N'-[(Z)-2-aminoethenyl]piperazine-1-carboximidamide (CID 155722729) is N'-[(Z)-2-aminoethenyl]piperazine-1-carboximidamide.

What is the SMILES notation for N'-[(Z)-2-aminoethenyl]piperazine-1-carboximidamide?

The canonical SMILES for N'-[(Z)-2-aminoethenyl]piperazine-1-carboximidamide is N/C=C\N=C(/N)N1CCNCC1.

What is the InChIKey of N'-[(Z)-2-aminoethenyl]piperazine-1-carboximidamide?

The InChIKey is RSSLYKGDRMUVKG-UPHRSURJSA-N. The full InChI is InChI=1S/C7H15N5/c8-1-2-11-7(9)12-5-3-10-4-6-12/h1-2,10H,3-6,8H2,(H2,9,11)/b2-1-.

What are the key properties of N'-[(Z)-2-aminoethenyl]piperazine-1-carboximidamide?

N'-[(Z)-2-aminoethenyl]piperazine-1-carboximidamide has a molecular weight of 169.23 g/mol, XLogP of -1.36, 1 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.

Where does this data come from?

All data for N'-[(Z)-2-aminoethenyl]piperazine-1-carboximidamide is sourced from PubChem (CID 155722729), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Sources

• PubChem CID 155722729 — identifiers, structure, computed properties (public domain)

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