1-(3-chlorophenyl)-4-methylpiperazine

C11H15ClN2 — CID 14960351

IUPAC1-(3-chlorophenyl)-4-methylpiperazine
SMILESCN1CCN(c2cccc(Cl)c2)CC1
InChIInChI=1S/C11H15ClN2/c1-13-5-7-14(8-6-13)11-4-2-3-10(12)9-11/h2-4,9H,5-8H2,1H3
InChIKeyBGVQAXHXGFPYTQ-UHFFFAOYSA-N
MW210.71 g/mol
LogP2.09
Rot. Bonds1

About 1-(3-chlorophenyl)-4-methylpiperazine

1-(3-chlorophenyl)-4-methylpiperazine (PubChem CID 14960351) has the molecular formula C11H15ClN2 and a molecular weight of 210.71 g/mol. Its IUPAC name is 1-(3-chlorophenyl)-4-methylpiperazine.

Molecular Properties

Compound Name1-(3-chlorophenyl)-4-methylpiperazine
PubChem CID14960351
Molecular FormulaC11H15ClN2
Molecular Weight210.71 g/mol
Exact Mass210.09
IUPAC Name1-(3-chlorophenyl)-4-methylpiperazine
SMILESCN1CCN(c2cccc(Cl)c2)CC1
InChIInChI=1S/C11H15ClN2/c1-13-5-7-14(8-6-13)11-4-2-3-10(12)9-11/h2-4,9H,5-8H2,1H3
InChIKeyBGVQAXHXGFPYTQ-UHFFFAOYSA-N
XLogP2.09
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.71
LogP ≤ 52.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-(3-Chlorophenyl)piperazine
CID 1355
1-(2,3-Dichlorophenyl)piperazine
CID 851833
1,1-Dimethyl-4-phenylpiperazinium iodide
CID 5911
1-(3-Chlorophenyl)piperazine monohydrochloride
CID 25681
1-(3-Chlorophenyl)-4-(3-chloropropyl)piperazinium chloride
CID 13035120
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
4-Chloro-N,N-dimethylaniline
CID 136530
1-(3,4-Dichlorophenyl)piperazine
CID 93601
1-(3,5-Dichlorophenyl)piperazine
CID 2736067

Frequently Asked Questions

What is the IUPAC name of 1-(3-chlorophenyl)-4-methylpiperazine?
The IUPAC name of 1-(3-chlorophenyl)-4-methylpiperazine (CID 14960351) is 1-(3-chlorophenyl)-4-methylpiperazine.
What is the SMILES notation for 1-(3-chlorophenyl)-4-methylpiperazine?
The canonical SMILES for 1-(3-chlorophenyl)-4-methylpiperazine is CN1CCN(c2cccc(Cl)c2)CC1.
What is the InChIKey of 1-(3-chlorophenyl)-4-methylpiperazine?
The InChIKey is BGVQAXHXGFPYTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15ClN2/c1-13-5-7-14(8-6-13)11-4-2-3-10(12)9-11/h2-4,9H,5-8H2,1H3.
What are the key properties of 1-(3-chlorophenyl)-4-methylpiperazine?
1-(3-chlorophenyl)-4-methylpiperazine has a molecular weight of 210.71 g/mol, XLogP of 2.09, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-chlorophenyl)-4-methylpiperazine is sourced from PubChem (CID 14960351), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).