1-(3-chlorophenyl)-3-methyl-3-phenylpiperazine

C17H19ClN2 — CID 64923880

IUPAC1-(3-chlorophenyl)-3-methyl-3-phenylpiperazine
SMILESCC1(c2ccccc2)CN(c2cccc(Cl)c2)CCN1
InChIInChI=1S/C17H19ClN2/c1-17(14-6-3-2-4-7-14)13-20(11-10-19-17)16-9-5-8-15(18)12-16/h2-9,12,19H,10-11,13H2,1H3
InChIKeyJTTZPGNSKLHSHP-UHFFFAOYSA-N
MW286.81 g/mol
LogP3.66
Rot. Bonds2

About 1-(3-chlorophenyl)-3-methyl-3-phenylpiperazine

1-(3-chlorophenyl)-3-methyl-3-phenylpiperazine (PubChem CID 64923880) has the molecular formula C17H19ClN2 and a molecular weight of 286.81 g/mol. Its IUPAC name is 1-(3-chlorophenyl)-3-methyl-3-phenylpiperazine.

Molecular Properties

Compound Name1-(3-chlorophenyl)-3-methyl-3-phenylpiperazine
PubChem CID64923880
Molecular FormulaC17H19ClN2
Molecular Weight286.81 g/mol
Exact Mass286.12
IUPAC Name1-(3-chlorophenyl)-3-methyl-3-phenylpiperazine
SMILESCC1(c2ccccc2)CN(c2cccc(Cl)c2)CCN1
InChIInChI=1S/C17H19ClN2/c1-17(14-6-3-2-4-7-14)13-20(11-10-19-17)16-9-5-8-15(18)12-16/h2-9,12,19H,10-11,13H2,1H3
InChIKeyJTTZPGNSKLHSHP-UHFFFAOYSA-N
XLogP3.66
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.81
LogP ≤ 53.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-(3-chlorophenyl)-3-methyl-3-phenylpiperazine 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-(3,5-dichlorophenyl)-3-methyl-3-phenylpiperazine
CID 64926056
1-(4-chlorophenyl)-3-methyl-3-phenylpiperazine
CID 64924864
1-(4-chloro-2-fluorophenyl)-3-methyl-3-phenylpiperazine
CID 64925327
1-(3-bromo-4-fluorophenyl)-3-methyl-3-phenylpiperazine
CID 104781762
1-(2,3-dichlorophenyl)-3-methyl-3-phenylpiperazine
CID 64924892
1-(5-bromo-2-chlorophenyl)-3-methyl-3-phenylpiperazine
CID 64952590
1-(2,6-difluorophenyl)-3-methyl-3-phenylpiperazine
CID 64926018
1-(2-bromophenyl)-3-methyl-3-phenylpiperazine
CID 64925876
1-(4-bromophenyl)-3-methyl-3-phenyl-1,4-diazepane
CID 64944364
1-(2-fluoro-4-methylphenyl)-3-methyl-3-phenylpiperazine
CID 64924832
10-(3-chlorophenyl)-6,10-diazaspiro[4.6]undecane
CID 64944935
(3R)-1-(3-chlorophenyl)-3-methylpiperazine
CID 10822374

Frequently Asked Questions

What is the IUPAC name of 1-(3-chlorophenyl)-3-methyl-3-phenylpiperazine?
The IUPAC name of 1-(3-chlorophenyl)-3-methyl-3-phenylpiperazine (CID 64923880) is 1-(3-chlorophenyl)-3-methyl-3-phenylpiperazine.
What is the SMILES notation for 1-(3-chlorophenyl)-3-methyl-3-phenylpiperazine?
The canonical SMILES for 1-(3-chlorophenyl)-3-methyl-3-phenylpiperazine is CC1(c2ccccc2)CN(c2cccc(Cl)c2)CCN1.
What is the InChIKey of 1-(3-chlorophenyl)-3-methyl-3-phenylpiperazine?
The InChIKey is JTTZPGNSKLHSHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19ClN2/c1-17(14-6-3-2-4-7-14)13-20(11-10-19-17)16-9-5-8-15(18)12-16/h2-9,12,19H,10-11,13H2,1H3.
What are the key properties of 1-(3-chlorophenyl)-3-methyl-3-phenylpiperazine?
1-(3-chlorophenyl)-3-methyl-3-phenylpiperazine has a molecular weight of 286.81 g/mol, XLogP of 3.66, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-chlorophenyl)-3-methyl-3-phenylpiperazine is sourced from PubChem (CID 64923880), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).