5-cyclopropyl-1-(2,6-dibromophenyl)-2-methylpiperazine

C14H18Br2N2 — CID 107603836

IUPAC5-cyclopropyl-1-(2,6-dibromophenyl)-2-methylpiperazine
SMILESCC1CNC(C2CC2)CN1c1c(Br)cccc1Br
InChIInChI=1S/C14H18Br2N2/c1-9-7-17-13(10-5-6-10)8-18(9)14-11(15)3-2-4-12(14)16/h2-4,9-10,13,17H,5-8H2,1H3
InChIKeyNWDBHLZLZUPXKM-UHFFFAOYSA-N
MW374.12 g/mol
LogP3.79
Rot. Bonds2

About 5-cyclopropyl-1-(2,6-dibromophenyl)-2-methylpiperazine

5-cyclopropyl-1-(2,6-dibromophenyl)-2-methylpiperazine (PubChem CID 107603836) has the molecular formula C14H18Br2N2 and a molecular weight of 374.12 g/mol. Its IUPAC name is 5-cyclopropyl-1-(2,6-dibromophenyl)-2-methylpiperazine.

Molecular Properties

Compound Name5-cyclopropyl-1-(2,6-dibromophenyl)-2-methylpiperazine
PubChem CID107603836
Molecular FormulaC14H18Br2N2
Molecular Weight374.12 g/mol
Exact Mass371.98
IUPAC Name5-cyclopropyl-1-(2,6-dibromophenyl)-2-methylpiperazine
SMILESCC1CNC(C2CC2)CN1c1c(Br)cccc1Br
InChIInChI=1S/C14H18Br2N2/c1-9-7-17-13(10-5-6-10)8-18(9)14-11(15)3-2-4-12(14)16/h2-4,9-10,13,17H,5-8H2,1H3
InChIKeyNWDBHLZLZUPXKM-UHFFFAOYSA-N
XLogP3.79
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.12
LogP ≤ 53.79
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-cyclopropyl-1-(2,6-dibromophenyl)-2-propan-2-ylpiperazine
CID 107603823
1-(2-bromo-5-methylphenyl)-5-cyclopropyl-2-methylpiperazine
CID 82758492
1-(2,6-dibromophenyl)-2-methyl-5-(2-methylpropyl)piperazine
CID 107603846
1-(4-bromo-2,5-difluorophenyl)-5-cyclopropyl-2-methylpiperazine
CID 107608147
1-(4-bromo-3-methoxyphenyl)-5-cyclopropyl-2-methylpiperazine
CID 82861136
1-(4-chlorophenyl)-5-cyclopropyl-2-methylpiperazine
CID 64933898
5-cyclopropyl-1-(2,4-dimethylphenyl)-2-methylpiperazine
CID 64930667
5-cyclopropyl-2-methyl-1-[4-(trifluoromethyl)phenyl]piperazine
CID 64932560
1-(3-chloro-2-fluorophenyl)-5-cyclohexyl-2-methylpiperazine
CID 64935682
1-(2-bromo-6-fluorophenyl)-2-methyl-5-(2-methylpropyl)piperazine
CID 107603926
5-cyclopropyl-2-methyl-1-(4-propoxyphenyl)piperazine
CID 64946803
5-cyclopropyl-1-(2,5-dimethoxyphenyl)-2-methylpiperazine
CID 64932759

Frequently Asked Questions

What is the IUPAC name of 5-cyclopropyl-1-(2,6-dibromophenyl)-2-methylpiperazine?
The IUPAC name of 5-cyclopropyl-1-(2,6-dibromophenyl)-2-methylpiperazine (CID 107603836) is 5-cyclopropyl-1-(2,6-dibromophenyl)-2-methylpiperazine.
What is the SMILES notation for 5-cyclopropyl-1-(2,6-dibromophenyl)-2-methylpiperazine?
The canonical SMILES for 5-cyclopropyl-1-(2,6-dibromophenyl)-2-methylpiperazine is CC1CNC(C2CC2)CN1c1c(Br)cccc1Br.
What is the InChIKey of 5-cyclopropyl-1-(2,6-dibromophenyl)-2-methylpiperazine?
The InChIKey is NWDBHLZLZUPXKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18Br2N2/c1-9-7-17-13(10-5-6-10)8-18(9)14-11(15)3-2-4-12(14)16/h2-4,9-10,13,17H,5-8H2,1H3.
What are the key properties of 5-cyclopropyl-1-(2,6-dibromophenyl)-2-methylpiperazine?
5-cyclopropyl-1-(2,6-dibromophenyl)-2-methylpiperazine has a molecular weight of 374.12 g/mol, XLogP of 3.79, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclopropyl-1-(2,6-dibromophenyl)-2-methylpiperazine is sourced from PubChem (CID 107603836), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).