2,2-di(piperazin-1-yl)ethanimine

C10H21N5 — CID 56996932

IUPAC2,2-di(piperazin-1-yl)ethanimine
SMILES[H]/N=C/C(N1CCNCC1)N1CCNCC1
InChIInChI=1S/C10H21N5/c11-9-10(14-5-1-12-2-6-14)15-7-3-13-4-8-15/h9-13H,1-8H2/b11-9+
InChIKeyIWBIILNHJLRDFR-PKNBQFBNSA-N
MW211.31 g/mol
LogP-1.23
Rot. Bonds3

About 2,2-di(piperazin-1-yl)ethanimine

2,2-di(piperazin-1-yl)ethanimine (PubChem CID 56996932) has the molecular formula C10H21N5 and a molecular weight of 211.31 g/mol. Its IUPAC name is 2,2-di(piperazin-1-yl)ethanimine.

Molecular Properties

Compound Name2,2-di(piperazin-1-yl)ethanimine
PubChem CID56996932
Molecular FormulaC10H21N5
Molecular Weight211.31 g/mol
Exact Mass211.18
IUPAC Name2,2-di(piperazin-1-yl)ethanimine
SMILES[H]/N=C/C(N1CCNCC1)N1CCNCC1
InChIInChI=1S/C10H21N5/c11-9-10(14-5-1-12-2-6-14)15-7-3-13-4-8-15/h9-13H,1-8H2/b11-9+
InChIKeyIWBIILNHJLRDFR-PKNBQFBNSA-N
XLogP-1.23
TPSA54.39 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.31
LogP ≤ 5-1.23
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

2,2-di(piperazin-1-yl)acetaldehyde
CID 87096321
2-(3-piperazin-1-ylbut-1-en-2-yloxy)ethanimine
CID 123378360
1-propan-2-ylpiperazine;vanadium
CID 162375922
1-piperazin-1-ylprop-2-en-1-ol
CID 66821299
2-piperazin-1-ylbutanimidamide
CID 54261988
1-[(Z)-pent-3-en-2-yl]piperazine
CID 70169405
(E)-3-piperazin-1-ylbut-2-en-1-imine
CID 142245533
1-(1-cyclohexylsulfanylethyl)piperazine
CID 117035774
2-(1,3-dioxoisoindol-2-yl)-2-piperazin-1-ylacetaldehyde
CID 90700522
1-methyl-7-propan-2-yl-1,4,7,10-tetrazacyclododecane
CID 145053856
1-propan-2-ylpiperazine;1-propan-2-ylpiperidine;1-propan-2-ylpyrrolidine
CID 158027588
N-(1-piperazin-1-ylethyl)formamide
CID 87225423

Frequently Asked Questions

What is the IUPAC name of 2,2-di(piperazin-1-yl)ethanimine?
The IUPAC name of 2,2-di(piperazin-1-yl)ethanimine (CID 56996932) is 2,2-di(piperazin-1-yl)ethanimine.
What is the SMILES notation for 2,2-di(piperazin-1-yl)ethanimine?
The canonical SMILES for 2,2-di(piperazin-1-yl)ethanimine is [H]/N=C/C(N1CCNCC1)N1CCNCC1.
What is the InChIKey of 2,2-di(piperazin-1-yl)ethanimine?
The InChIKey is IWBIILNHJLRDFR-PKNBQFBNSA-N. The full InChI is InChI=1S/C10H21N5/c11-9-10(14-5-1-12-2-6-14)15-7-3-13-4-8-15/h9-13H,1-8H2/b11-9+.
What are the key properties of 2,2-di(piperazin-1-yl)ethanimine?
2,2-di(piperazin-1-yl)ethanimine has a molecular weight of 211.31 g/mol, XLogP of -1.23, 3 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-di(piperazin-1-yl)ethanimine is sourced from PubChem (CID 56996932), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).