1-(2-methylbutyl)-2-(2-methylpropyl)piperazine

C13H28N2 — CID 64846849

IUPAC1-(2-methylbutyl)-2-(2-methylpropyl)piperazine
SMILESCCC(C)CN1CCNCC1CC(C)C
InChIInChI=1S/C13H28N2/c1-5-12(4)10-15-7-6-14-9-13(15)8-11(2)3/h11-14H,5-10H2,1-4H3
InChIKeyDXMJINYXAYFCEF-UHFFFAOYSA-N
MW212.38 g/mol
LogP2.35
Rot. Bonds5

About 1-(2-methylbutyl)-2-(2-methylpropyl)piperazine

1-(2-methylbutyl)-2-(2-methylpropyl)piperazine (PubChem CID 64846849) has the molecular formula C13H28N2 and a molecular weight of 212.38 g/mol. Its IUPAC name is 1-(2-methylbutyl)-2-(2-methylpropyl)piperazine.

Molecular Properties

Compound Name1-(2-methylbutyl)-2-(2-methylpropyl)piperazine
PubChem CID64846849
Molecular FormulaC13H28N2
Molecular Weight212.38 g/mol
Exact Mass212.23
IUPAC Name1-(2-methylbutyl)-2-(2-methylpropyl)piperazine
SMILESCCC(C)CN1CCNCC1CC(C)C
InChIInChI=1S/C13H28N2/c1-5-12(4)10-15-7-6-14-9-13(15)8-11(2)3/h11-14H,5-10H2,1-4H3
InChIKeyDXMJINYXAYFCEF-UHFFFAOYSA-N
XLogP2.35
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.38
LogP ≤ 52.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(2-methylbutyl)-2-(2-methylpropyl)piperazine?
The IUPAC name of 1-(2-methylbutyl)-2-(2-methylpropyl)piperazine (CID 64846849) is 1-(2-methylbutyl)-2-(2-methylpropyl)piperazine.
What is the SMILES notation for 1-(2-methylbutyl)-2-(2-methylpropyl)piperazine?
The canonical SMILES for 1-(2-methylbutyl)-2-(2-methylpropyl)piperazine is CCC(C)CN1CCNCC1CC(C)C.
What is the InChIKey of 1-(2-methylbutyl)-2-(2-methylpropyl)piperazine?
The InChIKey is DXMJINYXAYFCEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28N2/c1-5-12(4)10-15-7-6-14-9-13(15)8-11(2)3/h11-14H,5-10H2,1-4H3.
What are the key properties of 1-(2-methylbutyl)-2-(2-methylpropyl)piperazine?
1-(2-methylbutyl)-2-(2-methylpropyl)piperazine has a molecular weight of 212.38 g/mol, XLogP of 2.35, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methylbutyl)-2-(2-methylpropyl)piperazine is sourced from PubChem (CID 64846849), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).