3-(2,4-dimethoxy-3-methylphenyl)-1-methylpiperazine

C14H22N2O2 — CID 82297569

IUPAC3-(2,4-dimethoxy-3-methylphenyl)-1-methylpiperazine
SMILESCOc1ccc(C2CN(C)CCN2)c(OC)c1C
InChIInChI=1S/C14H22N2O2/c1-10-13(17-3)6-5-11(14(10)18-4)12-9-16(2)8-7-15-12/h5-6,12,15H,7-9H2,1-4H3
InChIKeyPPTBKBKZJMYGQQ-UHFFFAOYSA-N
MW250.34 g/mol
LogP1.59
Rot. Bonds3

About 3-(2,4-dimethoxy-3-methylphenyl)-1-methylpiperazine

3-(2,4-dimethoxy-3-methylphenyl)-1-methylpiperazine (PubChem CID 82297569) has the molecular formula C14H22N2O2 and a molecular weight of 250.34 g/mol. Its IUPAC name is 3-(2,4-dimethoxy-3-methylphenyl)-1-methylpiperazine.

Molecular Properties

Compound Name3-(2,4-dimethoxy-3-methylphenyl)-1-methylpiperazine
PubChem CID82297569
Molecular FormulaC14H22N2O2
Molecular Weight250.34 g/mol
Exact Mass250.17
IUPAC Name3-(2,4-dimethoxy-3-methylphenyl)-1-methylpiperazine
SMILESCOc1ccc(C2CN(C)CCN2)c(OC)c1C
InChIInChI=1S/C14H22N2O2/c1-10-13(17-3)6-5-11(14(10)18-4)12-9-16(2)8-7-15-12/h5-6,12,15H,7-9H2,1-4H3
InChIKeyPPTBKBKZJMYGQQ-UHFFFAOYSA-N
XLogP1.59
TPSA33.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.34
LogP ≤ 51.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 3-(2,4-dimethoxy-3-methylphenyl)-1-methylpiperazine 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

3-(2-methoxy-5-methylphenyl)-1-methylpiperazine
CID 82114400
3-[(4-methoxy-2,3-dimethylphenyl)methyl]-1-methylpiperazine
CID 116928133
(4-methoxy-2,3-dimethylphenyl)-(4-methylpiperazin-2-yl)methanamine
CID 116941397
3-(4-methoxy-3-propan-2-ylphenyl)-1-methylpiperazine
CID 82118990
6-methoxy-4-(4-methylpiperazin-2-yl)quinoline
CID 82665396
2-(4-methylpiperazin-2-yl)phenol
CID 83445266
3-(7-methoxy-1-benzofuran-3-yl)-1-methyl-1,4-diazepane
CID 82665857
1,7-dimethyl-3-(4-methylpiperazin-2-yl)indole
CID 82664533
3-(4-methoxy-2,3-dimethylphenyl)-1,4-thiazinane 1,1-dioxide
CID 82305632
5-(2-methoxyphenyl)-1-methyl-1,4-diazepane
CID 82286361
3-(5-bromofuran-2-yl)-1-methylpiperazine
CID 82664929
4-(2,4-dimethoxy-3-methylphenyl)azepane
CID 82297126

Frequently Asked Questions

What is the IUPAC name of 3-(2,4-dimethoxy-3-methylphenyl)-1-methylpiperazine?
The IUPAC name of 3-(2,4-dimethoxy-3-methylphenyl)-1-methylpiperazine (CID 82297569) is 3-(2,4-dimethoxy-3-methylphenyl)-1-methylpiperazine.
What is the SMILES notation for 3-(2,4-dimethoxy-3-methylphenyl)-1-methylpiperazine?
The canonical SMILES for 3-(2,4-dimethoxy-3-methylphenyl)-1-methylpiperazine is COc1ccc(C2CN(C)CCN2)c(OC)c1C.
What is the InChIKey of 3-(2,4-dimethoxy-3-methylphenyl)-1-methylpiperazine?
The InChIKey is PPTBKBKZJMYGQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O2/c1-10-13(17-3)6-5-11(14(10)18-4)12-9-16(2)8-7-15-12/h5-6,12,15H,7-9H2,1-4H3.
What are the key properties of 3-(2,4-dimethoxy-3-methylphenyl)-1-methylpiperazine?
3-(2,4-dimethoxy-3-methylphenyl)-1-methylpiperazine has a molecular weight of 250.34 g/mol, XLogP of 1.59, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,4-dimethoxy-3-methylphenyl)-1-methylpiperazine is sourced from PubChem (CID 82297569), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).