1-hex-2-enylpiperazine

C10H20N2 — CID 54035899

IUPAC1-hex-2-enylpiperazine
SMILESCCCC=CCN1CCNCC1
InChIInChI=1S/C10H20N2/c1-2-3-4-5-8-12-9-6-11-7-10-12/h4-5,11H,2-3,6-10H2,1H3
InChIKeyGCRRMHQJQVJPEP-UHFFFAOYSA-N
MW168.28 g/mol
LogP1.25
Rot. Bonds4

About 1-hex-2-enylpiperazine

1-hex-2-enylpiperazine (PubChem CID 54035899) has the molecular formula C10H20N2 and a molecular weight of 168.28 g/mol. Its IUPAC name is 1-hex-2-enylpiperazine.

Molecular Properties

Compound Name1-hex-2-enylpiperazine
PubChem CID54035899
Molecular FormulaC10H20N2
Molecular Weight168.28 g/mol
Exact Mass168.16
IUPAC Name1-hex-2-enylpiperazine
SMILESCCCC=CCN1CCNCC1
InChIInChI=1S/C10H20N2/c1-2-3-4-5-8-12-9-6-11-7-10-12/h4-5,11H,2-3,6-10H2,1H3
InChIKeyGCRRMHQJQVJPEP-UHFFFAOYSA-N
XLogP1.25
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.28
LogP ≤ 51.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

Piperazine, 1-(3,7,11-trimethyl-2,6,10-dodecatrienyl)-
CID 6445849
1-(3,7,11-Trimethyl-2,6,10-dodecatrienyl)piperazine
CID 3039323
Geranylpiperazine
CID 14497703
1-(3,7-Dimethylocta-2,6-dienyl)piperazine
CID 53785157
1-(2-Fluoronona-3,6-dien-5-yl)piperazine
CID 123142512
(2R,3R)-2,3-bis(2-methylprop-1-enyl)piperazine
CID 96014881
(2R,3R)-2,3-bis[(1E)-penta-1,4-dienyl]piperazine
CID 134925876
(2R,3R)-2,3-bis[(1E)-2-methylpenta-1,4-dienyl]piperazine
CID 134993990
(2R,3R)-2,3-bis[(E)-pent-1-enyl]piperazine
CID 134994082
(2R,3R)-2,3-bis[(E)-prop-1-enyl]piperazine
CID 134994271
1-But-3-en-2-ylpiperazine
CID 12530650
1-[(E)-but-2-enyl]piperazine
CID 12563613

Frequently Asked Questions

What is the IUPAC name of 1-hex-2-enylpiperazine?
The IUPAC name of 1-hex-2-enylpiperazine (CID 54035899) is 1-hex-2-enylpiperazine.
What is the SMILES notation for 1-hex-2-enylpiperazine?
The canonical SMILES for 1-hex-2-enylpiperazine is CCCC=CCN1CCNCC1.
What is the InChIKey of 1-hex-2-enylpiperazine?
The InChIKey is GCRRMHQJQVJPEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2/c1-2-3-4-5-8-12-9-6-11-7-10-12/h4-5,11H,2-3,6-10H2,1H3.
What are the key properties of 1-hex-2-enylpiperazine?
1-hex-2-enylpiperazine has a molecular weight of 168.28 g/mol, XLogP of 1.25, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-hex-2-enylpiperazine is sourced from PubChem (CID 54035899), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).