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

C14H22N2 — CID 116829218

IUPAC2-methyl-3-(2,4,6-trimethylphenyl)piperazine
SMILESCc1cc(C)c(C2NCCNC2C)c(C)c1
InChIInChI=1S/C14H22N2/c1-9-7-10(2)13(11(3)8-9)14-12(4)15-5-6-16-14/h7-8,12,14-16H,5-6H2,1-4H3
InChIKeyAFLLPTODDYROLA-UHFFFAOYSA-N
MW218.34 g/mol
LogP2.23
Rot. Bonds1

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

2-methyl-3-(2,4,6-trimethylphenyl)piperazine (PubChem CID 116829218) has the molecular formula C14H22N2 and a molecular weight of 218.34 g/mol. Its IUPAC name is 2-methyl-3-(2,4,6-trimethylphenyl)piperazine.

Molecular Properties

Compound Name2-methyl-3-(2,4,6-trimethylphenyl)piperazine
PubChem CID116829218
Molecular FormulaC14H22N2
Molecular Weight218.34 g/mol
Exact Mass218.18
IUPAC Name2-methyl-3-(2,4,6-trimethylphenyl)piperazine
SMILESCc1cc(C)c(C2NCCNC2C)c(C)c1
InChIInChI=1S/C14H22N2/c1-9-7-10(2)13(11(3)8-9)14-12(4)15-5-6-16-14/h7-8,12,14-16H,5-6H2,1-4H3
InChIKeyAFLLPTODDYROLA-UHFFFAOYSA-N
XLogP2.23
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.34
LogP ≤ 52.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 2-methyl-3-(2,4,6-trimethylphenyl)piperazine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(2S,3R)-2-methyl-3-(2,4,6-trimethylphenyl)aziridine
CID 59591642
2-methyl-3-(3-methylphenyl)piperazine
CID 116829299
2-(3-chloro-6-methoxy-2,4-dimethylphenyl)-3-methylpiperazine
CID 116829251
(2R)-2-(2,4,6-trimethylphenyl)azetidine;hydrochloride
CID 171197280
1-cyclopropyl-6,8-dimethyl-1,2,3,4-tetrahydroisoquinoline
CID 62373264
2-phenyl-3-(2,4,6-trimethylphenyl)pyrrolidine
CID 62718277
2-methyl-5-(2,4,6-trimethylphenyl)morpholine
CID 82286014
aziridine;(2R,3S)-3-(2,4,6-trimethylphenyl)aziridine-2-carboxylic acid
CID 160806727
2-(4-ethoxy-3-methylphenyl)-3-methylpiperazine
CID 116829237
(2S,3S)-2,3-dimethylpiperazine
CID 51614849
3-methyl-5-(2,4,6-trimethylphenyl)pyrazolidine
CID 78292069
ethane;1,5,7-trimethyl-2,3-dihydro-1H-indene
CID 166534855

Frequently Asked Questions

What is the IUPAC name of 2-methyl-3-(2,4,6-trimethylphenyl)piperazine?
The IUPAC name of 2-methyl-3-(2,4,6-trimethylphenyl)piperazine (CID 116829218) is 2-methyl-3-(2,4,6-trimethylphenyl)piperazine.
What is the SMILES notation for 2-methyl-3-(2,4,6-trimethylphenyl)piperazine?
The canonical SMILES for 2-methyl-3-(2,4,6-trimethylphenyl)piperazine is Cc1cc(C)c(C2NCCNC2C)c(C)c1.
What is the InChIKey of 2-methyl-3-(2,4,6-trimethylphenyl)piperazine?
The InChIKey is AFLLPTODDYROLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2/c1-9-7-10(2)13(11(3)8-9)14-12(4)15-5-6-16-14/h7-8,12,14-16H,5-6H2,1-4H3.
What are the key properties of 2-methyl-3-(2,4,6-trimethylphenyl)piperazine?
2-methyl-3-(2,4,6-trimethylphenyl)piperazine has a molecular weight of 218.34 g/mol, XLogP of 2.23, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-3-(2,4,6-trimethylphenyl)piperazine is sourced from PubChem (CID 116829218), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).