1-(1-methyl-4,5-dihydroimidazol-2-yl)piperazine;dihydrochloride

C8H18Cl2N4 — CID 18424133

IUPAC1-(1-methyl-4,5-dihydroimidazol-2-yl)piperazine;dihydrochloride
SMILESCN1CCN=C1N1CCNCC1.Cl.Cl
InChIInChI=1S/C8H16N4.2ClH/c1-11-5-4-10-8(11)12-6-2-9-3-7-12;;/h9H,2-7H2,1H3;2*1H
InChIKeyZJWVWGZLDDTFRE-UHFFFAOYSA-N
MW241.17 g/mol
LogP0.04
Rot. Bonds

About 1-(1-methyl-4,5-dihydroimidazol-2-yl)piperazine;dihydrochloride

1-(1-methyl-4,5-dihydroimidazol-2-yl)piperazine;dihydrochloride (PubChem CID 18424133) has the molecular formula C8H18Cl2N4 and a molecular weight of 241.17 g/mol. Its IUPAC name is 1-(1-methyl-4,5-dihydroimidazol-2-yl)piperazine;dihydrochloride.

Molecular Properties

Compound Name1-(1-methyl-4,5-dihydroimidazol-2-yl)piperazine;dihydrochloride
PubChem CID18424133
Molecular FormulaC8H18Cl2N4
Molecular Weight241.17 g/mol
Exact Mass240.09
IUPAC Name1-(1-methyl-4,5-dihydroimidazol-2-yl)piperazine;dihydrochloride
SMILESCN1CCN=C1N1CCNCC1.Cl.Cl
InChIInChI=1S/C8H16N4.2ClH/c1-11-5-4-10-8(11)12-6-2-9-3-7-12;;/h9H,2-7H2,1H3;2*1H
InChIKeyZJWVWGZLDDTFRE-UHFFFAOYSA-N
XLogP0.04
TPSA30.87 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.17
LogP ≤ 50.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(1-methyl-4,5-dihydroimidazol-2-yl)piperazine;dihydrochloride?
The IUPAC name of 1-(1-methyl-4,5-dihydroimidazol-2-yl)piperazine;dihydrochloride (CID 18424133) is 1-(1-methyl-4,5-dihydroimidazol-2-yl)piperazine;dihydrochloride.
What is the SMILES notation for 1-(1-methyl-4,5-dihydroimidazol-2-yl)piperazine;dihydrochloride?
The canonical SMILES for 1-(1-methyl-4,5-dihydroimidazol-2-yl)piperazine;dihydrochloride is CN1CCN=C1N1CCNCC1.Cl.Cl.
What is the InChIKey of 1-(1-methyl-4,5-dihydroimidazol-2-yl)piperazine;dihydrochloride?
The InChIKey is ZJWVWGZLDDTFRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N4.2ClH/c1-11-5-4-10-8(11)12-6-2-9-3-7-12;;/h9H,2-7H2,1H3;2*1H.
What are the key properties of 1-(1-methyl-4,5-dihydroimidazol-2-yl)piperazine;dihydrochloride?
1-(1-methyl-4,5-dihydroimidazol-2-yl)piperazine;dihydrochloride has a molecular weight of 241.17 g/mol, XLogP of 0.04, 0 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-methyl-4,5-dihydroimidazol-2-yl)piperazine;dihydrochloride is sourced from PubChem (CID 18424133), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).