1,4-dimethylpiperazine-2-carboximidamide

C7H16N4 — CID 79662206

IUPAC1,4-dimethylpiperazine-2-carboximidamide
SMILES[H]/N=C(\N)C1CN(C)CCN1C
InChIInChI=1S/C7H16N4/c1-10-3-4-11(2)6(5-10)7(8)9/h6H,3-5H2,1-2H3,(H3,8,9)
InChIKeyWQKOIECENUNIKL-UHFFFAOYSA-N
MW156.23 g/mol
LogP-0.83
Rot. Bonds1

About 1,4-dimethylpiperazine-2-carboximidamide

1,4-dimethylpiperazine-2-carboximidamide (PubChem CID 79662206) has the molecular formula C7H16N4 and a molecular weight of 156.23 g/mol. Its IUPAC name is 1,4-dimethylpiperazine-2-carboximidamide.

Molecular Properties

Compound Name1,4-dimethylpiperazine-2-carboximidamide
PubChem CID79662206
Molecular FormulaC7H16N4
Molecular Weight156.23 g/mol
Exact Mass156.14
IUPAC Name1,4-dimethylpiperazine-2-carboximidamide
SMILES[H]/N=C(\N)C1CN(C)CCN1C
InChIInChI=1S/C7H16N4/c1-10-3-4-11(2)6(5-10)7(8)9/h6H,3-5H2,1-2H3,(H3,8,9)
InChIKeyWQKOIECENUNIKL-UHFFFAOYSA-N
XLogP-0.83
TPSA56.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.23
LogP ≤ 5-0.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1,4-dimethylpiperazine-2-carboximidamide?
The IUPAC name of 1,4-dimethylpiperazine-2-carboximidamide (CID 79662206) is 1,4-dimethylpiperazine-2-carboximidamide.
What is the SMILES notation for 1,4-dimethylpiperazine-2-carboximidamide?
The canonical SMILES for 1,4-dimethylpiperazine-2-carboximidamide is [H]/N=C(\N)C1CN(C)CCN1C.
What is the InChIKey of 1,4-dimethylpiperazine-2-carboximidamide?
The InChIKey is WQKOIECENUNIKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H16N4/c1-10-3-4-11(2)6(5-10)7(8)9/h6H,3-5H2,1-2H3,(H3,8,9).
What are the key properties of 1,4-dimethylpiperazine-2-carboximidamide?
1,4-dimethylpiperazine-2-carboximidamide has a molecular weight of 156.23 g/mol, XLogP of -0.83, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1,4-dimethylpiperazine-2-carboximidamide is sourced from PubChem (CID 79662206), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).