4-butyl-1,2,6-trimethylpiperazine

C11H24N2 — CID 126991132

IUPAC4-butyl-1,2,6-trimethylpiperazine
SMILESCCCCN1CC(C)N(C)C(C)C1
InChIInChI=1S/C11H24N2/c1-5-6-7-13-8-10(2)12(4)11(3)9-13/h10-11H,5-9H2,1-4H3
InChIKeyJFMJEJDEDZLZTK-UHFFFAOYSA-N
MW184.33 g/mol
LogP1.81
Rot. Bonds3

About 4-butyl-1,2,6-trimethylpiperazine

4-butyl-1,2,6-trimethylpiperazine (PubChem CID 126991132) has the molecular formula C11H24N2 and a molecular weight of 184.33 g/mol. Its IUPAC name is 4-butyl-1,2,6-trimethylpiperazine.

Molecular Properties

Compound Name4-butyl-1,2,6-trimethylpiperazine
PubChem CID126991132
Molecular FormulaC11H24N2
Molecular Weight184.33 g/mol
Exact Mass184.19
IUPAC Name4-butyl-1,2,6-trimethylpiperazine
SMILESCCCCN1CC(C)N(C)C(C)C1
InChIInChI=1S/C11H24N2/c1-5-6-7-13-8-10(2)12(4)11(3)9-13/h10-11H,5-9H2,1-4H3
InChIKeyJFMJEJDEDZLZTK-UHFFFAOYSA-N
XLogP1.81
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.33
LogP ≤ 51.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(2S,6R)-4-ethyl-1,2,6-trimethylpiperazine
CID 138484607
5-(3,4,5-trimethylpiperazin-1-yl)pentan-2-amine
CID 114537725
N-propyl-5-(3,4,5-trimethylpiperazin-1-yl)pentan-2-amine
CID 114537915
1-(3,4,5-trimethylpiperazin-1-yl)hexan-2-amine
CID 114547111
N-ethyl-6-(3,4,5-trimethylpiperazin-1-yl)hexan-3-amine
CID 106800125
2-methyl-5-(3,4,5-trimethylpiperazin-1-yl)pentan-2-amine
CID 114547158
4,10-dibutyl-4,10-diazatetracyclo[5.5.2.02,6.08,12]tetradecane
CID 162493113
N-[4-(3,4,5-trimethylpiperazin-1-yl)butyl]cyclopropanamine
CID 114540197
2-butyl-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrole
CID 123306364
propane;(2R)-1,2,4,6-tetramethylpiperazine
CID 143144472
1-ethyl-2,6-dimethyl-4-(4-methylpentyl)piperazine
CID 123267329
(2S,6S)-1,2,6-trimethyl-4-(2-methylpropyl)piperazine
CID 171515774

Frequently Asked Questions

What is the IUPAC name of 4-butyl-1,2,6-trimethylpiperazine?
The IUPAC name of 4-butyl-1,2,6-trimethylpiperazine (CID 126991132) is 4-butyl-1,2,6-trimethylpiperazine.
What is the SMILES notation for 4-butyl-1,2,6-trimethylpiperazine?
The canonical SMILES for 4-butyl-1,2,6-trimethylpiperazine is CCCCN1CC(C)N(C)C(C)C1.
What is the InChIKey of 4-butyl-1,2,6-trimethylpiperazine?
The InChIKey is JFMJEJDEDZLZTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2/c1-5-6-7-13-8-10(2)12(4)11(3)9-13/h10-11H,5-9H2,1-4H3.
What are the key properties of 4-butyl-1,2,6-trimethylpiperazine?
4-butyl-1,2,6-trimethylpiperazine has a molecular weight of 184.33 g/mol, XLogP of 1.81, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-butyl-1,2,6-trimethylpiperazine is sourced from PubChem (CID 126991132), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).