1-methyl-3-[(1-methylimidazol-2-yl)methyl]piperazine

C10H18N4 — CID 83443620

IUPAC1-methyl-3-[(1-methylimidazol-2-yl)methyl]piperazine
SMILESCN1CCNC(Cc2nccn2C)C1
InChIInChI=1S/C10H18N4/c1-13-5-3-11-9(8-13)7-10-12-4-6-14(10)2/h4,6,9,11H,3,5,7-8H2,1-2H3
InChIKeyGFCVEYZDPUEUIE-UHFFFAOYSA-N
MW194.28 g/mol
LogP-0.13
Rot. Bonds2

About 1-methyl-3-[(1-methylimidazol-2-yl)methyl]piperazine

1-methyl-3-[(1-methylimidazol-2-yl)methyl]piperazine (PubChem CID 83443620) has the molecular formula C10H18N4 and a molecular weight of 194.28 g/mol. Its IUPAC name is 1-methyl-3-[(1-methylimidazol-2-yl)methyl]piperazine.

Molecular Properties

Compound Name1-methyl-3-[(1-methylimidazol-2-yl)methyl]piperazine
PubChem CID83443620
Molecular FormulaC10H18N4
Molecular Weight194.28 g/mol
Exact Mass194.15
IUPAC Name1-methyl-3-[(1-methylimidazol-2-yl)methyl]piperazine
SMILESCN1CCNC(Cc2nccn2C)C1
InChIInChI=1S/C10H18N4/c1-13-5-3-11-9(8-13)7-10-12-4-6-14(10)2/h4,6,9,11H,3,5,7-8H2,1-2H3
InChIKeyGFCVEYZDPUEUIE-UHFFFAOYSA-N
XLogP-0.13
TPSA33.09 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.28
LogP ≤ 5-0.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-methyl-2-(pyrrolidin-2-ylmethyl)imidazole;hydrochloride
CID 71298900
2-[(1-methylimidazol-2-yl)methyl]-4-(trifluoromethyl)piperidine
CID 106780517
1-methyl-3-(1H-pyrrol-3-ylmethyl)piperazine
CID 116928127
1-methyl-3-(pyrazol-1-ylmethyl)piperazine
CID 90232368
1-(cyclobutylmethyl)-3-[(1-methylimidazol-2-yl)methyl]piperidine
CID 86771066
3-[[4-(1,1-difluoroethyl)phenyl]methyl]-1-methylpiperazine
CID 116991840
5-[(4-methylpiperazin-2-yl)methyl]-1,2-dihydropyrazol-3-one
CID 83847703
3-[(2,4-dimethylphenyl)methyl]-1-methylpiperazine
CID 82285679
3-ethyl-1-methylpiperazine;hydrochloride
CID 138111979
N-[2-(4-methylpiperazin-2-yl)ethyl]-5-propylpyrimidin-2-amine
CID 116976042
N-methyl-N-[(1-methylimidazol-2-yl)methyl]-1-[(2R)-pyrrolidin-2-yl]methanamine
CID 94939254
2-[[1-(2-methoxyethyl)pyrrolidin-3-yl]methyl]-1-methylimidazole
CID 110269241

Frequently Asked Questions

What is the IUPAC name of 1-methyl-3-[(1-methylimidazol-2-yl)methyl]piperazine?
The IUPAC name of 1-methyl-3-[(1-methylimidazol-2-yl)methyl]piperazine (CID 83443620) is 1-methyl-3-[(1-methylimidazol-2-yl)methyl]piperazine.
What is the SMILES notation for 1-methyl-3-[(1-methylimidazol-2-yl)methyl]piperazine?
The canonical SMILES for 1-methyl-3-[(1-methylimidazol-2-yl)methyl]piperazine is CN1CCNC(Cc2nccn2C)C1.
What is the InChIKey of 1-methyl-3-[(1-methylimidazol-2-yl)methyl]piperazine?
The InChIKey is GFCVEYZDPUEUIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N4/c1-13-5-3-11-9(8-13)7-10-12-4-6-14(10)2/h4,6,9,11H,3,5,7-8H2,1-2H3.
What are the key properties of 1-methyl-3-[(1-methylimidazol-2-yl)methyl]piperazine?
1-methyl-3-[(1-methylimidazol-2-yl)methyl]piperazine has a molecular weight of 194.28 g/mol, XLogP of -0.13, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-3-[(1-methylimidazol-2-yl)methyl]piperazine is sourced from PubChem (CID 83443620), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).