1-methyl-4-(4-methylpentan-2-yl)piperazine

C11H24N2 — CID 59222439

IUPAC1-methyl-4-(4-methylpentan-2-yl)piperazine
SMILESCC(C)CC(C)N1CCN(C)CC1
InChIInChI=1S/C11H24N2/c1-10(2)9-11(3)13-7-5-12(4)6-8-13/h10-11H,5-9H2,1-4H3
InChIKeySUSWBFUCMLMRAH-UHFFFAOYSA-N
MW184.33 g/mol
LogP1.67
Rot. Bonds3

About 1-methyl-4-(4-methylpentan-2-yl)piperazine

1-methyl-4-(4-methylpentan-2-yl)piperazine (PubChem CID 59222439) has the molecular formula C11H24N2 and a molecular weight of 184.33 g/mol. Its IUPAC name is 1-methyl-4-(4-methylpentan-2-yl)piperazine.

Molecular Properties

Compound Name1-methyl-4-(4-methylpentan-2-yl)piperazine
PubChem CID59222439
Molecular FormulaC11H24N2
Molecular Weight184.33 g/mol
Exact Mass184.19
IUPAC Name1-methyl-4-(4-methylpentan-2-yl)piperazine
SMILESCC(C)CC(C)N1CCN(C)CC1
InChIInChI=1S/C11H24N2/c1-10(2)9-11(3)13-7-5-12(4)6-8-13/h10-11H,5-9H2,1-4H3
InChIKeySUSWBFUCMLMRAH-UHFFFAOYSA-N
XLogP1.67
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 ≤ 51.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-4-(4-methylpentan-2-yl)piperazine?
The IUPAC name of 1-methyl-4-(4-methylpentan-2-yl)piperazine (CID 59222439) is 1-methyl-4-(4-methylpentan-2-yl)piperazine.
What is the SMILES notation for 1-methyl-4-(4-methylpentan-2-yl)piperazine?
The canonical SMILES for 1-methyl-4-(4-methylpentan-2-yl)piperazine is CC(C)CC(C)N1CCN(C)CC1.
What is the InChIKey of 1-methyl-4-(4-methylpentan-2-yl)piperazine?
The InChIKey is SUSWBFUCMLMRAH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2/c1-10(2)9-11(3)13-7-5-12(4)6-8-13/h10-11H,5-9H2,1-4H3.
What are the key properties of 1-methyl-4-(4-methylpentan-2-yl)piperazine?
1-methyl-4-(4-methylpentan-2-yl)piperazine has a molecular weight of 184.33 g/mol, XLogP of 1.67, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-4-(4-methylpentan-2-yl)piperazine is sourced from PubChem (CID 59222439), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).