1-(2,4-dichlorophenyl)piperazine

C10H12Cl2N2 — CID 2737527

IUPAC1-(2,4-dichlorophenyl)piperazine
SMILESClc1ccc(N2CCNCC2)c(Cl)c1
InChIInChI=1S/C10H12Cl2N2/c11-8-1-2-10(9(12)7-8)14-5-3-13-4-6-14/h1-2,7,13H,3-6H2
InChIKeyYSJHCQGGIPTMQM-UHFFFAOYSA-N
MW231.13 g/mol
LogP2.40
Rot. Bonds1

About 1-(2,4-dichlorophenyl)piperazine

1-(2,4-dichlorophenyl)piperazine (PubChem CID 2737527) has the molecular formula C10H12Cl2N2 and a molecular weight of 231.13 g/mol. Its IUPAC name is 1-(2,4-dichlorophenyl)piperazine.

Molecular Properties

Compound Name1-(2,4-dichlorophenyl)piperazine
PubChem CID2737527
Molecular FormulaC10H12Cl2N2
Molecular Weight231.13 g/mol
Exact Mass230.04
IUPAC Name1-(2,4-dichlorophenyl)piperazine
SMILESClc1ccc(N2CCNCC2)c(Cl)c1
InChIInChI=1S/C10H12Cl2N2/c11-8-1-2-10(9(12)7-8)14-5-3-13-4-6-14/h1-2,7,13H,3-6H2
InChIKeyYSJHCQGGIPTMQM-UHFFFAOYSA-N
XLogP2.40
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.13
LogP ≤ 52.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(3-Chlorophenyl)piperazine
CID 1355
1-(2,3-Dichlorophenyl)piperazine
CID 851833
1-(3-Chlorophenyl)piperazine monohydrochloride
CID 25681
1-(4-Chlorophenyl)piperazine
CID 97478
1-(2-Chlorophenyl)piperazine
CID 415628
1-(3-Chlorophenyl)piperazine dihydrochloride
CID 11957487
1-(4-Chlorophenyl)-2-methylpiperazine
CID 98289
1-(3,4-Dichlorophenyl)piperazine
CID 93601
1-(3,5-Dichlorophenyl)piperazine
CID 2736067
1-(4-Chlorophenyl)-4-hexylpiperazine
CID 3738741
3-Chloro-4-(piperidin-1-yl)aniline
CID 736350
N-(4-chlorophenyl)-1-ethyl-4-piperidinamine
CID 868366

Frequently Asked Questions

What is the IUPAC name of 1-(2,4-dichlorophenyl)piperazine?
The IUPAC name of 1-(2,4-dichlorophenyl)piperazine (CID 2737527) is 1-(2,4-dichlorophenyl)piperazine.
What is the SMILES notation for 1-(2,4-dichlorophenyl)piperazine?
The canonical SMILES for 1-(2,4-dichlorophenyl)piperazine is Clc1ccc(N2CCNCC2)c(Cl)c1.
What is the InChIKey of 1-(2,4-dichlorophenyl)piperazine?
The InChIKey is YSJHCQGGIPTMQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12Cl2N2/c11-8-1-2-10(9(12)7-8)14-5-3-13-4-6-14/h1-2,7,13H,3-6H2.
What are the key properties of 1-(2,4-dichlorophenyl)piperazine?
1-(2,4-dichlorophenyl)piperazine has a molecular weight of 231.13 g/mol, XLogP of 2.40, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,4-dichlorophenyl)piperazine is sourced from PubChem (CID 2737527), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).