1-(2,6-dibromophenyl)-2-methyl-5-(2-methylpropyl)piperazine

C15H22Br2N2 — CID 107603846

IUPAC1-(2,6-dibromophenyl)-2-methyl-5-(2-methylpropyl)piperazine
SMILESCC(C)CC1CN(c2c(Br)cccc2Br)C(C)CN1
InChIInChI=1S/C15H22Br2N2/c1-10(2)7-12-9-19(11(3)8-18-12)15-13(16)5-4-6-14(15)17/h4-6,10-12,18H,7-9H2,1-3H3
InChIKeyNVAYGXKJJNFECM-UHFFFAOYSA-N
MW390.16 g/mol
LogP4.42
Rot. Bonds3

About 1-(2,6-dibromophenyl)-2-methyl-5-(2-methylpropyl)piperazine

1-(2,6-dibromophenyl)-2-methyl-5-(2-methylpropyl)piperazine (PubChem CID 107603846) has the molecular formula C15H22Br2N2 and a molecular weight of 390.16 g/mol. Its IUPAC name is 1-(2,6-dibromophenyl)-2-methyl-5-(2-methylpropyl)piperazine.

Molecular Properties

Compound Name1-(2,6-dibromophenyl)-2-methyl-5-(2-methylpropyl)piperazine
PubChem CID107603846
Molecular FormulaC15H22Br2N2
Molecular Weight390.16 g/mol
Exact Mass388.01
IUPAC Name1-(2,6-dibromophenyl)-2-methyl-5-(2-methylpropyl)piperazine
SMILESCC(C)CC1CN(c2c(Br)cccc2Br)C(C)CN1
InChIInChI=1S/C15H22Br2N2/c1-10(2)7-12-9-19(11(3)8-18-12)15-13(16)5-4-6-14(15)17/h4-6,10-12,18H,7-9H2,1-3H3
InChIKeyNVAYGXKJJNFECM-UHFFFAOYSA-N
XLogP4.42
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500390.16
LogP ≤ 54.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2-bromo-6-fluorophenyl)-2-methyl-5-(2-methylpropyl)piperazine
CID 107603926
1-(2,6-dibromophenyl)-2-ethyl-5-(2-methylpropyl)piperazine
CID 107603860
1-(2,4-dibromophenyl)-2-methyl-5-(2-methylpropyl)piperazine
CID 64946822
1-(2-bromo-6-fluorophenyl)-2-ethyl-5-(2-methylpropyl)piperazine
CID 107603940
1-(3-fluoro-2-methylphenyl)-2-methyl-5-(2-methylpropyl)piperazine
CID 64946904
2-methyl-5-(2-methylpropyl)-1-(2-methylsulfanylphenyl)piperazine
CID 107646391
2-methyl-5-(2-methylpropyl)-1-(3-methylsulfanylphenyl)piperazine
CID 64934482
1-(3-chloro-2-fluorophenyl)-2-methyl-5-(2-methylpropyl)piperazine
CID 64935877
1-(3-bromo-2-methylphenyl)-5-(2-methylpropyl)-2-propan-2-ylpiperazine
CID 107639844
5-cyclopropyl-1-(2,6-dibromophenyl)-2-methylpiperazine
CID 107603836
1-(4-ethoxyphenyl)-2-methyl-5-(2-methylpropyl)piperazine
CID 64930366
1-(2,4-difluorophenyl)-2-methyl-5-(2-methylpropyl)piperazine
CID 64930047

Frequently Asked Questions

What is the IUPAC name of 1-(2,6-dibromophenyl)-2-methyl-5-(2-methylpropyl)piperazine?
The IUPAC name of 1-(2,6-dibromophenyl)-2-methyl-5-(2-methylpropyl)piperazine (CID 107603846) is 1-(2,6-dibromophenyl)-2-methyl-5-(2-methylpropyl)piperazine.
What is the SMILES notation for 1-(2,6-dibromophenyl)-2-methyl-5-(2-methylpropyl)piperazine?
The canonical SMILES for 1-(2,6-dibromophenyl)-2-methyl-5-(2-methylpropyl)piperazine is CC(C)CC1CN(c2c(Br)cccc2Br)C(C)CN1.
What is the InChIKey of 1-(2,6-dibromophenyl)-2-methyl-5-(2-methylpropyl)piperazine?
The InChIKey is NVAYGXKJJNFECM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22Br2N2/c1-10(2)7-12-9-19(11(3)8-18-12)15-13(16)5-4-6-14(15)17/h4-6,10-12,18H,7-9H2,1-3H3.
What are the key properties of 1-(2,6-dibromophenyl)-2-methyl-5-(2-methylpropyl)piperazine?
1-(2,6-dibromophenyl)-2-methyl-5-(2-methylpropyl)piperazine has a molecular weight of 390.16 g/mol, XLogP of 4.42, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,6-dibromophenyl)-2-methyl-5-(2-methylpropyl)piperazine is sourced from PubChem (CID 107603846), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).