3-(4-ethylpiperazin-1-yl)pentanimidamide

C11H24N4 — CID 43368027

IUPAC3-(4-ethylpiperazin-1-yl)pentanimidamide
SMILES[H]/N=C(\N)CC(CC)N1CCN(CC)CC1
InChIInChI=1S/C11H24N4/c1-3-10(9-11(12)13)15-7-5-14(4-2)6-8-15/h10H,3-9H2,1-2H3,(H3,12,13)
InChIKeyLJBUURUJJSMJNC-UHFFFAOYSA-N
MW212.34 g/mol
LogP0.73
Rot. Bonds5

About 3-(4-ethylpiperazin-1-yl)pentanimidamide

3-(4-ethylpiperazin-1-yl)pentanimidamide (PubChem CID 43368027) has the molecular formula C11H24N4 and a molecular weight of 212.34 g/mol. Its IUPAC name is 3-(4-ethylpiperazin-1-yl)pentanimidamide.

Molecular Properties

Compound Name3-(4-ethylpiperazin-1-yl)pentanimidamide
PubChem CID43368027
Molecular FormulaC11H24N4
Molecular Weight212.34 g/mol
Exact Mass212.20
IUPAC Name3-(4-ethylpiperazin-1-yl)pentanimidamide
SMILES[H]/N=C(\N)CC(CC)N1CCN(CC)CC1
InChIInChI=1S/C11H24N4/c1-3-10(9-11(12)13)15-7-5-14(4-2)6-8-15/h10H,3-9H2,1-2H3,(H3,12,13)
InChIKeyLJBUURUJJSMJNC-UHFFFAOYSA-N
XLogP0.73
TPSA56.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.34
LogP ≤ 50.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 3-(4-ethylpiperazin-1-yl)pentanimidamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3-(4-ethylpiperazin-1-yl)pentanimidamide?
The IUPAC name of 3-(4-ethylpiperazin-1-yl)pentanimidamide (CID 43368027) is 3-(4-ethylpiperazin-1-yl)pentanimidamide.
What is the SMILES notation for 3-(4-ethylpiperazin-1-yl)pentanimidamide?
The canonical SMILES for 3-(4-ethylpiperazin-1-yl)pentanimidamide is [H]/N=C(\N)CC(CC)N1CCN(CC)CC1.
What is the InChIKey of 3-(4-ethylpiperazin-1-yl)pentanimidamide?
The InChIKey is LJBUURUJJSMJNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N4/c1-3-10(9-11(12)13)15-7-5-14(4-2)6-8-15/h10H,3-9H2,1-2H3,(H3,12,13).
What are the key properties of 3-(4-ethylpiperazin-1-yl)pentanimidamide?
3-(4-ethylpiperazin-1-yl)pentanimidamide has a molecular weight of 212.34 g/mol, XLogP of 0.73, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-ethylpiperazin-1-yl)pentanimidamide is sourced from PubChem (CID 43368027), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).