1-(4-chlorophenyl)-4-[(2-chlorophenyl)methyl]piperazine

C17H18Cl2N2 — CID 764693

IUPAC1-(4-chlorophenyl)-4-[(2-chlorophenyl)methyl]piperazine
SMILESClc1ccc(N2CCN(Cc3ccccc3Cl)CC2)cc1
InChIInChI=1S/C17H18Cl2N2/c18-15-5-7-16(8-6-15)21-11-9-20(10-12-21)13-14-3-1-2-4-17(14)19/h1-8H,9-13H2
InChIKeyCFZSTAZHERQKDY-UHFFFAOYSA-N
MW321.25 g/mol
LogP4.32
Rot. Bonds3

About 1-(4-chlorophenyl)-4-[(2-chlorophenyl)methyl]piperazine

1-(4-chlorophenyl)-4-[(2-chlorophenyl)methyl]piperazine (PubChem CID 764693) has the molecular formula C17H18Cl2N2 and a molecular weight of 321.25 g/mol. Its IUPAC name is 1-(4-chlorophenyl)-4-[(2-chlorophenyl)methyl]piperazine.

Molecular Properties

Compound Name1-(4-chlorophenyl)-4-[(2-chlorophenyl)methyl]piperazine
PubChem CID764693
Molecular FormulaC17H18Cl2N2
Molecular Weight321.25 g/mol
Exact Mass320.08
IUPAC Name1-(4-chlorophenyl)-4-[(2-chlorophenyl)methyl]piperazine
SMILESClc1ccc(N2CCN(Cc3ccccc3Cl)CC2)cc1
InChIInChI=1S/C17H18Cl2N2/c18-15-5-7-16(8-6-15)21-11-9-20(10-12-21)13-14-3-1-2-4-17(14)19/h1-8H,9-13H2
InChIKeyCFZSTAZHERQKDY-UHFFFAOYSA-N
XLogP4.32
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.25
LogP ≤ 54.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 1-(4-chlorophenyl)-4-[(2-chlorophenyl)methyl]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

1-[(2-chlorophenyl)methyl]-4-phenylpiperazine
CID 765042
1-(4-chlorophenyl)-4-[(2-phenylphenyl)methyl]piperazine
CID 71602582
1-(4-chlorophenyl)-4-[(2-methoxyphenyl)methyl]piperazine
CID 750588
1-(4-chlorophenyl)-4-[(2-nitrophenyl)methyl]piperazine
CID 785844
1-[[2-(4-chlorophenyl)phenyl]methyl]-4-(4-methylphenyl)piperazine
CID 130244404
1-[(2-chlorophenyl)methyl]azepane
CID 17017924
1-[(2-chlorophenyl)methyl]-4-sulfanylpiperazine
CID 135200099
1-[(2-chlorophenyl)methyl]-4-(2-chloro-4-pyrrol-1-ylphenyl)piperazine
CID 91674801
N-[4-[4-[(2-chlorophenyl)methyl]piperazin-1-yl]phenyl]-2,3,4,5,6-pentafluorobenzamide
CID 2084128
(4-chlorophenyl)-[4-[(2-chlorophenyl)methyl]piperazin-1-yl]methanone
CID 19294991
3,6-dichloro-N-[4-[4-[(2-chlorophenyl)methyl]piperazin-1-yl]phenyl]-1-benzothiophene-2-carboxamide
CID 5026183
1-[(2-chlorophenyl)methyl]-4-(2,3-dihydro-1,4-benzodioxin-6-yl)piperazine;oxalic acid
CID 18399627

Frequently Asked Questions

What is the IUPAC name of 1-(4-chlorophenyl)-4-[(2-chlorophenyl)methyl]piperazine?
The IUPAC name of 1-(4-chlorophenyl)-4-[(2-chlorophenyl)methyl]piperazine (CID 764693) is 1-(4-chlorophenyl)-4-[(2-chlorophenyl)methyl]piperazine.
What is the SMILES notation for 1-(4-chlorophenyl)-4-[(2-chlorophenyl)methyl]piperazine?
The canonical SMILES for 1-(4-chlorophenyl)-4-[(2-chlorophenyl)methyl]piperazine is Clc1ccc(N2CCN(Cc3ccccc3Cl)CC2)cc1.
What is the InChIKey of 1-(4-chlorophenyl)-4-[(2-chlorophenyl)methyl]piperazine?
The InChIKey is CFZSTAZHERQKDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18Cl2N2/c18-15-5-7-16(8-6-15)21-11-9-20(10-12-21)13-14-3-1-2-4-17(14)19/h1-8H,9-13H2.
What are the key properties of 1-(4-chlorophenyl)-4-[(2-chlorophenyl)methyl]piperazine?
1-(4-chlorophenyl)-4-[(2-chlorophenyl)methyl]piperazine has a molecular weight of 321.25 g/mol, XLogP of 4.32, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-chlorophenyl)-4-[(2-chlorophenyl)methyl]piperazine is sourced from PubChem (CID 764693), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).