1-(2,3-dichlorophenyl)piperazine

C10H12Cl2N2 — CID 851833

IUPAC1-(2,3-dichlorophenyl)piperazine
SMILESClc1cccc(N2CCNCC2)c1Cl
InChIInChI=1S/C10H12Cl2N2/c11-8-2-1-3-9(10(8)12)14-6-4-13-5-7-14/h1-3,13H,4-7H2
InChIKeyUDQMXYJSNNCRAS-UHFFFAOYSA-N
MW231.13 g/mol
LogP2.40
Rot. Bonds1

About 1-(2,3-dichlorophenyl)piperazine

1-(2,3-dichlorophenyl)piperazine (PubChem CID 851833) has the molecular formula C10H12Cl2N2 and a molecular weight of 231.13 g/mol. Its IUPAC name is 1-(2,3-dichlorophenyl)piperazine.

Molecular Properties

Compound Name1-(2,3-dichlorophenyl)piperazine
PubChem CID851833
Molecular FormulaC10H12Cl2N2
Molecular Weight231.13 g/mol
Exact Mass230.04
IUPAC Name1-(2,3-dichlorophenyl)piperazine
SMILESClc1cccc(N2CCNCC2)c1Cl
InChIInChI=1S/C10H12Cl2N2/c11-8-2-1-3-9(10(8)12)14-6-4-13-5-7-14/h1-3,13H,4-7H2
InChIKeyUDQMXYJSNNCRAS-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-(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-(3-Chlorophenyl)-4-(3-chloropropyl)piperazinium chloride
CID 13035120
1-(3-Chlorophenyl)-4-hexylpiperazine
CID 610696
1-(3-Chloro-phenyl)-4-pentyl-piperazine
CID 14960350
3-Chloro-4-(piperidin-1-yl)aniline
CID 736350

Frequently Asked Questions

What is the IUPAC name of 1-(2,3-dichlorophenyl)piperazine?
The IUPAC name of 1-(2,3-dichlorophenyl)piperazine (CID 851833) is 1-(2,3-dichlorophenyl)piperazine.
What is the SMILES notation for 1-(2,3-dichlorophenyl)piperazine?
The canonical SMILES for 1-(2,3-dichlorophenyl)piperazine is Clc1cccc(N2CCNCC2)c1Cl.
What is the InChIKey of 1-(2,3-dichlorophenyl)piperazine?
The InChIKey is UDQMXYJSNNCRAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12Cl2N2/c11-8-2-1-3-9(10(8)12)14-6-4-13-5-7-14/h1-3,13H,4-7H2.
What are the key properties of 1-(2,3-dichlorophenyl)piperazine?
1-(2,3-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-(2,3-dichlorophenyl)piperazine is sourced from PubChem (CID 851833), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).