1-[3-(2,6-dimethoxy-4-methylphenyl)propyl]-4-methylpiperazine

C17H28N2O2 — CID 170862913

IUPAC1-[3-(2,6-dimethoxy-4-methylphenyl)propyl]-4-methylpiperazine
SMILESCOc1cc(C)cc(OC)c1CCCN1CCN(C)CC1
InChIInChI=1S/C17H28N2O2/c1-14-12-16(20-3)15(17(13-14)21-4)6-5-7-19-10-8-18(2)9-11-19/h12-13H,5-11H2,1-4H3
InChIKeyWPTFHVXNTMNAMW-UHFFFAOYSA-N
MW292.42 g/mol
LogP2.19
Rot. Bonds6

About 1-[3-(2,6-dimethoxy-4-methylphenyl)propyl]-4-methylpiperazine

1-[3-(2,6-dimethoxy-4-methylphenyl)propyl]-4-methylpiperazine (PubChem CID 170862913) has the molecular formula C17H28N2O2 and a molecular weight of 292.42 g/mol. Its IUPAC name is 1-[3-(2,6-dimethoxy-4-methylphenyl)propyl]-4-methylpiperazine.

Molecular Properties

Compound Name1-[3-(2,6-dimethoxy-4-methylphenyl)propyl]-4-methylpiperazine
PubChem CID170862913
Molecular FormulaC17H28N2O2
Molecular Weight292.42 g/mol
Exact Mass292.22
IUPAC Name1-[3-(2,6-dimethoxy-4-methylphenyl)propyl]-4-methylpiperazine
SMILESCOc1cc(C)cc(OC)c1CCCN1CCN(C)CC1
InChIInChI=1S/C17H28N2O2/c1-14-12-16(20-3)15(17(13-14)21-4)6-5-7-19-10-8-18(2)9-11-19/h12-13H,5-11H2,1-4H3
InChIKeyWPTFHVXNTMNAMW-UHFFFAOYSA-N
XLogP2.19
TPSA24.94 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.42
LogP ≤ 52.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 1-[3-(2,6-dimethoxy-4-methylphenyl)propyl]-4-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

1-methyl-4-[3-(3,4,5-trimethoxyphenyl)propyl]piperazine
CID 170862320
1-[3-(2,5-dimethoxyphenyl)propyl]-4-methylpiperazine
CID 170862265
1-[3-(4-bromo-2,5-dimethoxyphenyl)propyl]-4-methylpiperazine
CID 170862894
4-methyl-2,6-bis[3-(4-methylpiperazin-1-yl)propyl]phenol
CID 170862381
1-[3-(6-methoxy-2,3-dihydro-1,4-benzodioxin-7-yl)propyl]-4-methylpiperazine
CID 170863940
1-methyl-4-[3-[2,3,5-trimethyl-6-[2-(2,4,6-trimethylphenyl)ethyl]phenyl]propyl]piperazine
CID 170862633
1-[3-(2,6-dimethoxyphenoxy)propyl]-4-methylpiperazine
CID 91276351
1-[2-(2-methoxy-4,6-dimethylphenyl)ethyl]piperazine
CID 82480406
2-methoxy-5-methyl-N-[3-(4-methylpiperazin-1-yl)propyl]benzenesulfonamide
CID 8824169
1-[3-(2-bromo-5-ethoxy-4-methoxyphenyl)propyl]-4-methylpiperazine
CID 170863578
N,N-diethyl-3-methoxy-4-[3-(4-methylpiperazin-1-yl)propyl]aniline
CID 170863148
1-[(2,6-dimethoxy-4-methylphenyl)methyl]piperidine
CID 166722775

Frequently Asked Questions

What is the IUPAC name of 1-[3-(2,6-dimethoxy-4-methylphenyl)propyl]-4-methylpiperazine?
The IUPAC name of 1-[3-(2,6-dimethoxy-4-methylphenyl)propyl]-4-methylpiperazine (CID 170862913) is 1-[3-(2,6-dimethoxy-4-methylphenyl)propyl]-4-methylpiperazine.
What is the SMILES notation for 1-[3-(2,6-dimethoxy-4-methylphenyl)propyl]-4-methylpiperazine?
The canonical SMILES for 1-[3-(2,6-dimethoxy-4-methylphenyl)propyl]-4-methylpiperazine is COc1cc(C)cc(OC)c1CCCN1CCN(C)CC1.
What is the InChIKey of 1-[3-(2,6-dimethoxy-4-methylphenyl)propyl]-4-methylpiperazine?
The InChIKey is WPTFHVXNTMNAMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H28N2O2/c1-14-12-16(20-3)15(17(13-14)21-4)6-5-7-19-10-8-18(2)9-11-19/h12-13H,5-11H2,1-4H3.
What are the key properties of 1-[3-(2,6-dimethoxy-4-methylphenyl)propyl]-4-methylpiperazine?
1-[3-(2,6-dimethoxy-4-methylphenyl)propyl]-4-methylpiperazine has a molecular weight of 292.42 g/mol, XLogP of 2.19, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[3-(2,6-dimethoxy-4-methylphenyl)propyl]-4-methylpiperazine is sourced from PubChem (CID 170862913), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).