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

C10H21N3 — CID 67594520

IUPAC(E)-4-piperazin-1-ylhex-3-en-3-amine
SMILESCC/C(N)=C(/CC)N1CCNCC1
InChIInChI=1S/C10H21N3/c1-3-9(11)10(4-2)13-7-5-12-6-8-13/h12H,3-8,11H2,1-2H3/b10-9+
InChIKeyWHKXELHKXIDTCQ-MDZDMXLPSA-N
MW183.30 g/mol
LogP0.88
Rot. Bonds3

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

(E)-4-piperazin-1-ylhex-3-en-3-amine (PubChem CID 67594520) has the molecular formula C10H21N3 and a molecular weight of 183.30 g/mol. Its IUPAC name is (E)-4-piperazin-1-ylhex-3-en-3-amine.

Molecular Properties

Compound Name(E)-4-piperazin-1-ylhex-3-en-3-amine
PubChem CID67594520
Molecular FormulaC10H21N3
Molecular Weight183.30 g/mol
Exact Mass183.17
IUPAC Name(E)-4-piperazin-1-ylhex-3-en-3-amine
SMILESCC/C(N)=C(/CC)N1CCNCC1
InChIInChI=1S/C10H21N3/c1-3-9(11)10(4-2)13-7-5-12-6-8-13/h12H,3-8,11H2,1-2H3/b10-9+
InChIKeyWHKXELHKXIDTCQ-MDZDMXLPSA-N
XLogP0.88
TPSA41.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.30
LogP ≤ 50.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (E)-4-piperazin-1-ylhex-3-en-3-amine?
The IUPAC name of (E)-4-piperazin-1-ylhex-3-en-3-amine (CID 67594520) is (E)-4-piperazin-1-ylhex-3-en-3-amine.
What is the SMILES notation for (E)-4-piperazin-1-ylhex-3-en-3-amine?
The canonical SMILES for (E)-4-piperazin-1-ylhex-3-en-3-amine is CC/C(N)=C(/CC)N1CCNCC1.
What is the InChIKey of (E)-4-piperazin-1-ylhex-3-en-3-amine?
The InChIKey is WHKXELHKXIDTCQ-MDZDMXLPSA-N. The full InChI is InChI=1S/C10H21N3/c1-3-9(11)10(4-2)13-7-5-12-6-8-13/h12H,3-8,11H2,1-2H3/b10-9+.
What are the key properties of (E)-4-piperazin-1-ylhex-3-en-3-amine?
(E)-4-piperazin-1-ylhex-3-en-3-amine has a molecular weight of 183.30 g/mol, XLogP of 0.88, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-4-piperazin-1-ylhex-3-en-3-amine is sourced from PubChem (CID 67594520), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).