1,4-bis(2-ethylbut-1-enyl)piperazine

C16H30N2 — CID 19841510

IUPAC1,4-bis(2-ethylbut-1-enyl)piperazine
SMILESCCC(=CN1CCN(C=C(CC)CC)CC1)CC
InChIInChI=1S/C16H30N2/c1-5-15(6-2)13-17-9-11-18(12-10-17)14-16(7-3)8-4/h13-14H,5-12H2,1-4H3
InChIKeyXFVOXBMBRBFWPU-UHFFFAOYSA-N
MW250.43 g/mol
LogP4.01
Rot. Bonds6

About 1,4-bis(2-ethylbut-1-enyl)piperazine

1,4-bis(2-ethylbut-1-enyl)piperazine (PubChem CID 19841510) has the molecular formula C16H30N2 and a molecular weight of 250.43 g/mol. Its IUPAC name is 1,4-bis(2-ethylbut-1-enyl)piperazine.

Molecular Properties

Compound Name1,4-bis(2-ethylbut-1-enyl)piperazine
PubChem CID19841510
Molecular FormulaC16H30N2
Molecular Weight250.43 g/mol
Exact Mass250.24
IUPAC Name1,4-bis(2-ethylbut-1-enyl)piperazine
SMILESCCC(=CN1CCN(C=C(CC)CC)CC1)CC
InChIInChI=1S/C16H30N2/c1-5-15(6-2)13-17-9-11-18(12-10-17)14-16(7-3)8-4/h13-14H,5-12H2,1-4H3
InChIKeyXFVOXBMBRBFWPU-UHFFFAOYSA-N
XLogP4.01
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.43
LogP ≤ 54.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1,4-bis(2-ethylbut-1-enyl)piperazine?
The IUPAC name of 1,4-bis(2-ethylbut-1-enyl)piperazine (CID 19841510) is 1,4-bis(2-ethylbut-1-enyl)piperazine.
What is the SMILES notation for 1,4-bis(2-ethylbut-1-enyl)piperazine?
The canonical SMILES for 1,4-bis(2-ethylbut-1-enyl)piperazine is CCC(=CN1CCN(C=C(CC)CC)CC1)CC.
What is the InChIKey of 1,4-bis(2-ethylbut-1-enyl)piperazine?
The InChIKey is XFVOXBMBRBFWPU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30N2/c1-5-15(6-2)13-17-9-11-18(12-10-17)14-16(7-3)8-4/h13-14H,5-12H2,1-4H3.
What are the key properties of 1,4-bis(2-ethylbut-1-enyl)piperazine?
1,4-bis(2-ethylbut-1-enyl)piperazine has a molecular weight of 250.43 g/mol, XLogP of 4.01, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,4-bis(2-ethylbut-1-enyl)piperazine is sourced from PubChem (CID 19841510), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).