4-ethylpiperazine-1-carboximidamide;hydroiodide

C7H17IN4 — CID 70042634

IUPAC4-ethylpiperazine-1-carboximidamide;hydroiodide
SMILESI.[H]/N=C(\N)N1CCN(CC)CC1
InChIInChI=1S/C7H16N4.HI/c1-2-10-3-5-11(6-4-10)7(8)9;/h2-6H2,1H3,(H3,8,9);1H
InChIKeyDMEQFWHCBPPSHN-UHFFFAOYSA-N
MW284.14 g/mol
LogP0.14
Rot. Bonds1

About 4-ethylpiperazine-1-carboximidamide;hydroiodide

4-ethylpiperazine-1-carboximidamide;hydroiodide (PubChem CID 70042634) has the molecular formula C7H17IN4 and a molecular weight of 284.14 g/mol. Its IUPAC name is 4-ethylpiperazine-1-carboximidamide;hydroiodide.

Molecular Properties

Compound Name4-ethylpiperazine-1-carboximidamide;hydroiodide
PubChem CID70042634
Molecular FormulaC7H17IN4
Molecular Weight284.14 g/mol
Exact Mass284.05
IUPAC Name4-ethylpiperazine-1-carboximidamide;hydroiodide
SMILESI.[H]/N=C(\N)N1CCN(CC)CC1
InChIInChI=1S/C7H16N4.HI/c1-2-10-3-5-11(6-4-10)7(8)9;/h2-6H2,1H3,(H3,8,9);1H
InChIKeyDMEQFWHCBPPSHN-UHFFFAOYSA-N
XLogP0.14
TPSA56.35 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.14
LogP ≤ 50.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 4-ethylpiperazine-1-carboximidamide;hydroiodide?
The IUPAC name of 4-ethylpiperazine-1-carboximidamide;hydroiodide (CID 70042634) is 4-ethylpiperazine-1-carboximidamide;hydroiodide.
What is the SMILES notation for 4-ethylpiperazine-1-carboximidamide;hydroiodide?
The canonical SMILES for 4-ethylpiperazine-1-carboximidamide;hydroiodide is I.[H]/N=C(\N)N1CCN(CC)CC1.
What is the InChIKey of 4-ethylpiperazine-1-carboximidamide;hydroiodide?
The InChIKey is DMEQFWHCBPPSHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H16N4.HI/c1-2-10-3-5-11(6-4-10)7(8)9;/h2-6H2,1H3,(H3,8,9);1H.
What are the key properties of 4-ethylpiperazine-1-carboximidamide;hydroiodide?
4-ethylpiperazine-1-carboximidamide;hydroiodide has a molecular weight of 284.14 g/mol, XLogP of 0.14, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethylpiperazine-1-carboximidamide;hydroiodide is sourced from PubChem (CID 70042634), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).