azane;(E)-4-piperazin-1-ylhex-3-en-3-amine

C10H27N5 — CID 67594519

IUPACazane;(E)-4-piperazin-1-ylhex-3-en-3-amine
SMILESCC/C(N)=C(/CC)N1CCNCC1.N.N
InChIInChI=1S/C10H21N3.2H3N/c1-3-9(11)10(4-2)13-7-5-12-6-8-13;;/h12H,3-8,11H2,1-2H3;2*1H3/b10-9+;;
InChIKeyQIGPQBWLLNQNGF-TTWKNDKESA-N
MW217.36 g/mol
LogP1.21
Rot. Bonds3

About azane;(E)-4-piperazin-1-ylhex-3-en-3-amine

azane;(E)-4-piperazin-1-ylhex-3-en-3-amine (PubChem CID 67594519) has the molecular formula C10H27N5 and a molecular weight of 217.36 g/mol. Its IUPAC name is azane;(E)-4-piperazin-1-ylhex-3-en-3-amine.

Molecular Properties

Compound Nameazane;(E)-4-piperazin-1-ylhex-3-en-3-amine
PubChem CID67594519
Molecular FormulaC10H27N5
Molecular Weight217.36 g/mol
Exact Mass217.23
IUPAC Nameazane;(E)-4-piperazin-1-ylhex-3-en-3-amine
SMILESCC/C(N)=C(/CC)N1CCNCC1.N.N
InChIInChI=1S/C10H21N3.2H3N/c1-3-9(11)10(4-2)13-7-5-12-6-8-13;;/h12H,3-8,11H2,1-2H3;2*1H3/b10-9+;;
InChIKeyQIGPQBWLLNQNGF-TTWKNDKESA-N
XLogP1.21
TPSA111.29 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.36
LogP ≤ 51.21
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 105

Analyze azane;(E)-4-piperazin-1-ylhex-3-en-3-amine 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 azane;(E)-4-piperazin-1-ylhex-3-en-3-amine?
The IUPAC name of azane;(E)-4-piperazin-1-ylhex-3-en-3-amine (CID 67594519) is azane;(E)-4-piperazin-1-ylhex-3-en-3-amine.
What is the SMILES notation for azane;(E)-4-piperazin-1-ylhex-3-en-3-amine?
The canonical SMILES for azane;(E)-4-piperazin-1-ylhex-3-en-3-amine is CC/C(N)=C(/CC)N1CCNCC1.N.N.
What is the InChIKey of azane;(E)-4-piperazin-1-ylhex-3-en-3-amine?
The InChIKey is QIGPQBWLLNQNGF-TTWKNDKESA-N. The full InChI is InChI=1S/C10H21N3.2H3N/c1-3-9(11)10(4-2)13-7-5-12-6-8-13;;/h12H,3-8,11H2,1-2H3;2*1H3/b10-9+;;.
What are the key properties of azane;(E)-4-piperazin-1-ylhex-3-en-3-amine?
azane;(E)-4-piperazin-1-ylhex-3-en-3-amine has a molecular weight of 217.36 g/mol, XLogP of 1.21, 3 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for azane;(E)-4-piperazin-1-ylhex-3-en-3-amine is sourced from PubChem (CID 67594519), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).