N,N',4-trimethylpiperazine-1-carboximidamide

C8H18N4 — CID 22957304

IUPACN,N',4-trimethylpiperazine-1-carboximidamide
SMILESC/N=C(\NC)N1CCN(C)CC1
InChIInChI=1S/C8H18N4/c1-9-8(10-2)12-6-4-11(3)5-7-12/h4-7H2,1-3H3,(H,9,10)
InChIKeyULJMZOINYOAUPD-UHFFFAOYSA-N
MW170.26 g/mol
LogP-0.56
Rot. Bonds

About N,N',4-trimethylpiperazine-1-carboximidamide

N,N',4-trimethylpiperazine-1-carboximidamide (PubChem CID 22957304) has the molecular formula C8H18N4 and a molecular weight of 170.26 g/mol. Its IUPAC name is N,N',4-trimethylpiperazine-1-carboximidamide.

Molecular Properties

Compound NameN,N',4-trimethylpiperazine-1-carboximidamide
PubChem CID22957304
Molecular FormulaC8H18N4
Molecular Weight170.26 g/mol
Exact Mass170.15
IUPAC NameN,N',4-trimethylpiperazine-1-carboximidamide
SMILESC/N=C(\NC)N1CCN(C)CC1
InChIInChI=1S/C8H18N4/c1-9-8(10-2)12-6-4-11(3)5-7-12/h4-7H2,1-3H3,(H,9,10)
InChIKeyULJMZOINYOAUPD-UHFFFAOYSA-N
XLogP-0.56
TPSA30.87 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.26
LogP ≤ 5-0.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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 N,N',4-trimethylpiperazine-1-carboximidamide?
The IUPAC name of N,N',4-trimethylpiperazine-1-carboximidamide (CID 22957304) is N,N',4-trimethylpiperazine-1-carboximidamide.
What is the SMILES notation for N,N',4-trimethylpiperazine-1-carboximidamide?
The canonical SMILES for N,N',4-trimethylpiperazine-1-carboximidamide is C/N=C(\NC)N1CCN(C)CC1.
What is the InChIKey of N,N',4-trimethylpiperazine-1-carboximidamide?
The InChIKey is ULJMZOINYOAUPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18N4/c1-9-8(10-2)12-6-4-11(3)5-7-12/h4-7H2,1-3H3,(H,9,10).
What are the key properties of N,N',4-trimethylpiperazine-1-carboximidamide?
N,N',4-trimethylpiperazine-1-carboximidamide has a molecular weight of 170.26 g/mol, XLogP of -0.56, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N',4-trimethylpiperazine-1-carboximidamide is sourced from PubChem (CID 22957304), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).