1-methyl-3-(2,4,6-trimethylphenyl)piperazine

C14H22N2 — CID 82114107

IUPAC1-methyl-3-(2,4,6-trimethylphenyl)piperazine
SMILESCc1cc(C)c(C2CN(C)CCN2)c(C)c1
InChIInChI=1S/C14H22N2/c1-10-7-11(2)14(12(3)8-10)13-9-16(4)6-5-15-13/h7-8,13,15H,5-6,9H2,1-4H3
InChIKeyGWPSGOOFDGEYOF-UHFFFAOYSA-N
MW218.34 g/mol
LogP2.19
Rot. Bonds1

About 1-methyl-3-(2,4,6-trimethylphenyl)piperazine

1-methyl-3-(2,4,6-trimethylphenyl)piperazine (PubChem CID 82114107) has the molecular formula C14H22N2 and a molecular weight of 218.34 g/mol. Its IUPAC name is 1-methyl-3-(2,4,6-trimethylphenyl)piperazine.

Molecular Properties

Compound Name1-methyl-3-(2,4,6-trimethylphenyl)piperazine
PubChem CID82114107
Molecular FormulaC14H22N2
Molecular Weight218.34 g/mol
Exact Mass218.18
IUPAC Name1-methyl-3-(2,4,6-trimethylphenyl)piperazine
SMILESCc1cc(C)c(C2CN(C)CCN2)c(C)c1
InChIInChI=1S/C14H22N2/c1-10-7-11(2)14(12(3)8-10)13-9-16(4)6-5-15-13/h7-8,13,15H,5-6,9H2,1-4H3
InChIKeyGWPSGOOFDGEYOF-UHFFFAOYSA-N
XLogP2.19
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.34
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2R)-2-(2,4,6-trimethylphenyl)azetidine;hydrochloride
CID 171197280
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2-(4-methylpiperazin-2-yl)-1-(2,4,6-trimethylphenyl)ethanone
CID 116920016
1-(4-methylpiperazin-2-yl)-N-[(2,4,6-trimethylphenyl)methyl]methanamine
CID 115238665
1-methyl-3-(2-methyl-1-benzofuran-3-yl)piperazine
CID 116987398
3-[(2,4-dimethylphenyl)methyl]-1-methylpiperazine
CID 82285679
1,4-dimethyl-2-(4-methylpiperazin-2-yl)indole
CID 82664535
3-(2-chloro-6-fluorophenyl)-1-methylpiperazine
CID 82288330
4-(4-methylpiperazin-2-yl)aniline
CID 66617407
2-(4-methylpiperazin-2-yl)phenol
CID 83445266
1-methyl-3-(1-methylpyrrol-3-yl)piperazine
CID 82280749
3-[2-(2-methoxy-4,6-dimethylphenyl)ethyl]-1-methylpiperazine
CID 116928311

Frequently Asked Questions

What is the IUPAC name of 1-methyl-3-(2,4,6-trimethylphenyl)piperazine?
The IUPAC name of 1-methyl-3-(2,4,6-trimethylphenyl)piperazine (CID 82114107) is 1-methyl-3-(2,4,6-trimethylphenyl)piperazine.
What is the SMILES notation for 1-methyl-3-(2,4,6-trimethylphenyl)piperazine?
The canonical SMILES for 1-methyl-3-(2,4,6-trimethylphenyl)piperazine is Cc1cc(C)c(C2CN(C)CCN2)c(C)c1.
What is the InChIKey of 1-methyl-3-(2,4,6-trimethylphenyl)piperazine?
The InChIKey is GWPSGOOFDGEYOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2/c1-10-7-11(2)14(12(3)8-10)13-9-16(4)6-5-15-13/h7-8,13,15H,5-6,9H2,1-4H3.
What are the key properties of 1-methyl-3-(2,4,6-trimethylphenyl)piperazine?
1-methyl-3-(2,4,6-trimethylphenyl)piperazine has a molecular weight of 218.34 g/mol, XLogP of 2.19, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-3-(2,4,6-trimethylphenyl)piperazine is sourced from PubChem (CID 82114107), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).