1-methyl-2-propan-2-ylpiperazine

C8H18N2 — CID 54484837

IUPAC1-methyl-2-propan-2-ylpiperazine
SMILESCC(C)C1CNCCN1C
InChIInChI=1S/C8H18N2/c1-7(2)8-6-9-4-5-10(8)3/h7-9H,4-6H2,1-3H3
InChIKeyZLIRFYITEGBFOY-UHFFFAOYSA-N
MW142.25 g/mol
LogP0.55
Rot. Bonds1

About 1-methyl-2-propan-2-ylpiperazine

1-methyl-2-propan-2-ylpiperazine (PubChem CID 54484837) has the molecular formula C8H18N2 and a molecular weight of 142.25 g/mol. Its IUPAC name is 1-methyl-2-propan-2-ylpiperazine.

Molecular Properties

Compound Name1-methyl-2-propan-2-ylpiperazine
PubChem CID54484837
Molecular FormulaC8H18N2
Molecular Weight142.25 g/mol
Exact Mass142.15
IUPAC Name1-methyl-2-propan-2-ylpiperazine
SMILESCC(C)C1CNCCN1C
InChIInChI=1S/C8H18N2/c1-7(2)8-6-9-4-5-10(8)3/h7-9H,4-6H2,1-3H3
InChIKeyZLIRFYITEGBFOY-UHFFFAOYSA-N
XLogP0.55
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.25
LogP ≤ 50.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-2-propan-2-ylpiperazine?
The IUPAC name of 1-methyl-2-propan-2-ylpiperazine (CID 54484837) is 1-methyl-2-propan-2-ylpiperazine.
What is the SMILES notation for 1-methyl-2-propan-2-ylpiperazine?
The canonical SMILES for 1-methyl-2-propan-2-ylpiperazine is CC(C)C1CNCCN1C.
What is the InChIKey of 1-methyl-2-propan-2-ylpiperazine?
The InChIKey is ZLIRFYITEGBFOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18N2/c1-7(2)8-6-9-4-5-10(8)3/h7-9H,4-6H2,1-3H3.
What are the key properties of 1-methyl-2-propan-2-ylpiperazine?
1-methyl-2-propan-2-ylpiperazine has a molecular weight of 142.25 g/mol, XLogP of 0.55, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-2-propan-2-ylpiperazine is sourced from PubChem (CID 54484837), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).