1,4-dimethylpiperazine

C6H14N2 — CID 7818

IUPAC1,4-dimethylpiperazine
SMILESCN1CCN(C)CC1
InChIInChI=1S/C6H14N2/c1-7-3-5-8(2)6-4-7/h3-6H2,1-2H3
InChIKeyRXYPXQSKLGGKOL-UHFFFAOYSA-N
MW114.19 g/mol
LogP-0.14
Rot. Bonds

About 1,4-dimethylpiperazine

1,4-dimethylpiperazine (PubChem CID 7818) has the molecular formula C6H14N2 and a molecular weight of 114.19 g/mol. Its IUPAC name is 1,4-dimethylpiperazine.

Molecular Properties

Compound Name1,4-dimethylpiperazine
PubChem CID7818
Molecular FormulaC6H14N2
Molecular Weight114.19 g/mol
Exact Mass114.12
IUPAC Name1,4-dimethylpiperazine
SMILESCN1CCN(C)CC1
InChIInChI=1S/C6H14N2/c1-7-3-5-8(2)6-4-7/h3-6H2,1-2H3
InChIKeyRXYPXQSKLGGKOL-UHFFFAOYSA-N
XLogP-0.14
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500114.19
LogP ≤ 5-0.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1,4-dimethylpiperazine?
The IUPAC name of 1,4-dimethylpiperazine (CID 7818) is 1,4-dimethylpiperazine.
What is the SMILES notation for 1,4-dimethylpiperazine?
The canonical SMILES for 1,4-dimethylpiperazine is CN1CCN(C)CC1.
What is the InChIKey of 1,4-dimethylpiperazine?
The InChIKey is RXYPXQSKLGGKOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H14N2/c1-7-3-5-8(2)6-4-7/h3-6H2,1-2H3.
What are the key properties of 1,4-dimethylpiperazine?
1,4-dimethylpiperazine has a molecular weight of 114.19 g/mol, XLogP of -0.14, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,4-dimethylpiperazine is sourced from PubChem (CID 7818), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).