N'-aminopiperazine-1-carboximidamide

C5H13N5 — CID 53470602

IUPACN'-aminopiperazine-1-carboximidamide
SMILESN/N=C(\N)N1CCNCC1
InChIInChI=1S/C5H13N5/c6-5(9-7)10-3-1-8-2-4-10/h8H,1-4,7H2,(H2,6,9)
InChIKeyUSAOHVMSBYKFFK-UHFFFAOYSA-N
MW143.19 g/mol
LogP-1.92
Rot. Bonds

About N'-aminopiperazine-1-carboximidamide

N'-aminopiperazine-1-carboximidamide (PubChem CID 53470602) has the molecular formula C5H13N5 and a molecular weight of 143.19 g/mol. Its IUPAC name is N'-aminopiperazine-1-carboximidamide.

Molecular Properties

Compound NameN'-aminopiperazine-1-carboximidamide
PubChem CID53470602
Molecular FormulaC5H13N5
Molecular Weight143.19 g/mol
Exact Mass143.12
IUPAC NameN'-aminopiperazine-1-carboximidamide
SMILESN/N=C(\N)N1CCNCC1
InChIInChI=1S/C5H13N5/c6-5(9-7)10-3-1-8-2-4-10/h8H,1-4,7H2,(H2,6,9)
InChIKeyUSAOHVMSBYKFFK-UHFFFAOYSA-N
XLogP-1.92
TPSA79.67 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.19
LogP ≤ 5-1.92
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N'-aminopiperazine-1-carboximidamide?
The IUPAC name of N'-aminopiperazine-1-carboximidamide (CID 53470602) is N'-aminopiperazine-1-carboximidamide.
What is the SMILES notation for N'-aminopiperazine-1-carboximidamide?
The canonical SMILES for N'-aminopiperazine-1-carboximidamide is N/N=C(\N)N1CCNCC1.
What is the InChIKey of N'-aminopiperazine-1-carboximidamide?
The InChIKey is USAOHVMSBYKFFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H13N5/c6-5(9-7)10-3-1-8-2-4-10/h8H,1-4,7H2,(H2,6,9).
What are the key properties of N'-aminopiperazine-1-carboximidamide?
N'-aminopiperazine-1-carboximidamide has a molecular weight of 143.19 g/mol, XLogP of -1.92, 0 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-aminopiperazine-1-carboximidamide is sourced from PubChem (CID 53470602), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).