1-ethenyl-4-(4-methyl-3-propan-2-ylpentyl)piperazine

C15H30N2 — CID 142315747

IUPAC1-ethenyl-4-(4-methyl-3-propan-2-ylpentyl)piperazine
SMILESC=CN1CCN(CCC(C(C)C)C(C)C)CC1
InChIInChI=1S/C15H30N2/c1-6-16-9-11-17(12-10-16)8-7-15(13(2)3)14(4)5/h6,13-15H,1,7-12H2,2-5H3
InChIKeyUDSZUCPKOMDXSC-UHFFFAOYSA-N
MW238.42 g/mol
LogP3.07
Rot. Bonds6

About 1-ethenyl-4-(4-methyl-3-propan-2-ylpentyl)piperazine

1-ethenyl-4-(4-methyl-3-propan-2-ylpentyl)piperazine (PubChem CID 142315747) has the molecular formula C15H30N2 and a molecular weight of 238.42 g/mol. Its IUPAC name is 1-ethenyl-4-(4-methyl-3-propan-2-ylpentyl)piperazine.

Molecular Properties

Compound Name1-ethenyl-4-(4-methyl-3-propan-2-ylpentyl)piperazine
PubChem CID142315747
Molecular FormulaC15H30N2
Molecular Weight238.42 g/mol
Exact Mass238.24
IUPAC Name1-ethenyl-4-(4-methyl-3-propan-2-ylpentyl)piperazine
SMILESC=CN1CCN(CCC(C(C)C)C(C)C)CC1
InChIInChI=1S/C15H30N2/c1-6-16-9-11-17(12-10-16)8-7-15(13(2)3)14(4)5/h6,13-15H,1,7-12H2,2-5H3
InChIKeyUDSZUCPKOMDXSC-UHFFFAOYSA-N
XLogP3.07
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.42
LogP ≤ 53.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-ethenyl-4-(4-methyl-3-propan-2-ylpentyl)piperazine?
The IUPAC name of 1-ethenyl-4-(4-methyl-3-propan-2-ylpentyl)piperazine (CID 142315747) is 1-ethenyl-4-(4-methyl-3-propan-2-ylpentyl)piperazine.
What is the SMILES notation for 1-ethenyl-4-(4-methyl-3-propan-2-ylpentyl)piperazine?
The canonical SMILES for 1-ethenyl-4-(4-methyl-3-propan-2-ylpentyl)piperazine is C=CN1CCN(CCC(C(C)C)C(C)C)CC1.
What is the InChIKey of 1-ethenyl-4-(4-methyl-3-propan-2-ylpentyl)piperazine?
The InChIKey is UDSZUCPKOMDXSC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2/c1-6-16-9-11-17(12-10-16)8-7-15(13(2)3)14(4)5/h6,13-15H,1,7-12H2,2-5H3.
What are the key properties of 1-ethenyl-4-(4-methyl-3-propan-2-ylpentyl)piperazine?
1-ethenyl-4-(4-methyl-3-propan-2-ylpentyl)piperazine has a molecular weight of 238.42 g/mol, XLogP of 3.07, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethenyl-4-(4-methyl-3-propan-2-ylpentyl)piperazine is sourced from PubChem (CID 142315747), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).