1-methyl-2-[5-(2-methylphenyl)-1H-imidazol-2-yl]piperazine

C15H20N4 — CID 116881093

IUPAC1-methyl-2-[5-(2-methylphenyl)-1H-imidazol-2-yl]piperazine
SMILESCc1ccccc1-c1cnc(C2CNCCN2C)[nH]1
InChIInChI=1S/C15H20N4/c1-11-5-3-4-6-12(11)13-9-17-15(18-13)14-10-16-7-8-19(14)2/h3-6,9,14,16H,7-8,10H2,1-2H3,(H,17,18)
InChIKeyUQFSYMUXBIWTAS-UHFFFAOYSA-N
MW256.35 g/mol
LogP1.96
Rot. Bonds2

About 1-methyl-2-[5-(2-methylphenyl)-1H-imidazol-2-yl]piperazine

1-methyl-2-[5-(2-methylphenyl)-1H-imidazol-2-yl]piperazine (PubChem CID 116881093) has the molecular formula C15H20N4 and a molecular weight of 256.35 g/mol. Its IUPAC name is 1-methyl-2-[5-(2-methylphenyl)-1H-imidazol-2-yl]piperazine.

Molecular Properties

Compound Name1-methyl-2-[5-(2-methylphenyl)-1H-imidazol-2-yl]piperazine
PubChem CID116881093
Molecular FormulaC15H20N4
Molecular Weight256.35 g/mol
Exact Mass256.17
IUPAC Name1-methyl-2-[5-(2-methylphenyl)-1H-imidazol-2-yl]piperazine
SMILESCc1ccccc1-c1cnc(C2CNCCN2C)[nH]1
InChIInChI=1S/C15H20N4/c1-11-5-3-4-6-12(11)13-9-17-15(18-13)14-10-16-7-8-19(14)2/h3-6,9,14,16H,7-8,10H2,1-2H3,(H,17,18)
InChIKeyUQFSYMUXBIWTAS-UHFFFAOYSA-N
XLogP1.96
TPSA43.95 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.35
LogP ≤ 51.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-methyl-2-(5-methyl-1H-imidazol-2-yl)piperazine
CID 116881081
1-methyl-2-[5-(1H-pyrrol-3-yl)-1H-imidazol-2-yl]piperazine
CID 116881089
2-[5-(2-methylphenyl)-1H-imidazol-2-yl]morpholine
CID 116881044
5-(2-methylphenyl)-3-(1-methylpiperazin-2-yl)-1,2,4-oxadiazole
CID 120959013
(2S)-2-(2-fluorophenyl)-1-methylpiperazine
CID 28804930
(2S)-2-(1H-imidazol-2-yl)-1-methylpiperazine
CID 96902399
2-(1-methylpiperazin-2-yl)-4-pyridin-2-ylpyrimidine
CID 116901846
2-chloro-5-(2-methylphenyl)-1H-imidazole
CID 105446616
5-[2-[(2-methylphenyl)methoxy]phenyl]-3-(1-methylpiperazin-2-yl)-1,2,4-oxadiazole;hydrochloride
CID 120961282
2-[(2S)-2-[5-(2-fluorophenyl)-1H-imidazol-2-yl]pyrrolidin-1-yl]-4-methylpyrimidine
CID 95635150
4-(5-methylfuran-2-yl)-2-(1-methylpiperazin-2-yl)pyrimidine
CID 116901849
3-methyl-6-(1-methylpiperazin-2-yl)quinoline
CID 116997812

Frequently Asked Questions

What is the IUPAC name of 1-methyl-2-[5-(2-methylphenyl)-1H-imidazol-2-yl]piperazine?
The IUPAC name of 1-methyl-2-[5-(2-methylphenyl)-1H-imidazol-2-yl]piperazine (CID 116881093) is 1-methyl-2-[5-(2-methylphenyl)-1H-imidazol-2-yl]piperazine.
What is the SMILES notation for 1-methyl-2-[5-(2-methylphenyl)-1H-imidazol-2-yl]piperazine?
The canonical SMILES for 1-methyl-2-[5-(2-methylphenyl)-1H-imidazol-2-yl]piperazine is Cc1ccccc1-c1cnc(C2CNCCN2C)[nH]1.
What is the InChIKey of 1-methyl-2-[5-(2-methylphenyl)-1H-imidazol-2-yl]piperazine?
The InChIKey is UQFSYMUXBIWTAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4/c1-11-5-3-4-6-12(11)13-9-17-15(18-13)14-10-16-7-8-19(14)2/h3-6,9,14,16H,7-8,10H2,1-2H3,(H,17,18).
What are the key properties of 1-methyl-2-[5-(2-methylphenyl)-1H-imidazol-2-yl]piperazine?
1-methyl-2-[5-(2-methylphenyl)-1H-imidazol-2-yl]piperazine has a molecular weight of 256.35 g/mol, XLogP of 1.96, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-2-[5-(2-methylphenyl)-1H-imidazol-2-yl]piperazine is sourced from PubChem (CID 116881093), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).