1-methyl-4-propan-2-yl-2-propan-2-ylidenepiperazine

C11H22N2 — CID 89209695

IUPAC1-methyl-4-propan-2-yl-2-propan-2-ylidenepiperazine
SMILESCC(C)=C1CN(C(C)C)CCN1C
InChIInChI=1S/C11H22N2/c1-9(2)11-8-13(10(3)4)7-6-12(11)5/h10H,6-8H2,1-5H3
InChIKeySSZOAKPWYNNNEI-UHFFFAOYSA-N
MW182.31 g/mol
LogP1.94
Rot. Bonds1

About 1-methyl-4-propan-2-yl-2-propan-2-ylidenepiperazine

1-methyl-4-propan-2-yl-2-propan-2-ylidenepiperazine (PubChem CID 89209695) has the molecular formula C11H22N2 and a molecular weight of 182.31 g/mol. Its IUPAC name is 1-methyl-4-propan-2-yl-2-propan-2-ylidenepiperazine.

Molecular Properties

Compound Name1-methyl-4-propan-2-yl-2-propan-2-ylidenepiperazine
PubChem CID89209695
Molecular FormulaC11H22N2
Molecular Weight182.31 g/mol
Exact Mass182.18
IUPAC Name1-methyl-4-propan-2-yl-2-propan-2-ylidenepiperazine
SMILESCC(C)=C1CN(C(C)C)CCN1C
InChIInChI=1S/C11H22N2/c1-9(2)11-8-13(10(3)4)7-6-12(11)5/h10H,6-8H2,1-5H3
InChIKeySSZOAKPWYNNNEI-UHFFFAOYSA-N
XLogP1.94
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.31
LogP ≤ 51.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-4-propan-2-yl-2-propan-2-ylidenepiperazine?
The IUPAC name of 1-methyl-4-propan-2-yl-2-propan-2-ylidenepiperazine (CID 89209695) is 1-methyl-4-propan-2-yl-2-propan-2-ylidenepiperazine.
What is the SMILES notation for 1-methyl-4-propan-2-yl-2-propan-2-ylidenepiperazine?
The canonical SMILES for 1-methyl-4-propan-2-yl-2-propan-2-ylidenepiperazine is CC(C)=C1CN(C(C)C)CCN1C.
What is the InChIKey of 1-methyl-4-propan-2-yl-2-propan-2-ylidenepiperazine?
The InChIKey is SSZOAKPWYNNNEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2/c1-9(2)11-8-13(10(3)4)7-6-12(11)5/h10H,6-8H2,1-5H3.
What are the key properties of 1-methyl-4-propan-2-yl-2-propan-2-ylidenepiperazine?
1-methyl-4-propan-2-yl-2-propan-2-ylidenepiperazine has a molecular weight of 182.31 g/mol, XLogP of 1.94, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-4-propan-2-yl-2-propan-2-ylidenepiperazine is sourced from PubChem (CID 89209695), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).