1-(2,5-dibromophenyl)-2,5-diethyl-5-methylpiperazine

C15H22Br2N2 — CID 64933819

IUPAC1-(2,5-dibromophenyl)-2,5-diethyl-5-methylpiperazine
SMILESCCC1CNC(C)(CC)CN1c1cc(Br)ccc1Br
InChIInChI=1S/C15H22Br2N2/c1-4-12-9-18-15(3,5-2)10-19(12)14-8-11(16)6-7-13(14)17/h6-8,12,18H,4-5,9-10H2,1-3H3
InChIKeyAKHBRKWKUPTYCA-UHFFFAOYSA-N
MW390.16 g/mol
LogP4.57
Rot. Bonds3

About 1-(2,5-dibromophenyl)-2,5-diethyl-5-methylpiperazine

1-(2,5-dibromophenyl)-2,5-diethyl-5-methylpiperazine (PubChem CID 64933819) has the molecular formula C15H22Br2N2 and a molecular weight of 390.16 g/mol. Its IUPAC name is 1-(2,5-dibromophenyl)-2,5-diethyl-5-methylpiperazine.

Molecular Properties

Compound Name1-(2,5-dibromophenyl)-2,5-diethyl-5-methylpiperazine
PubChem CID64933819
Molecular FormulaC15H22Br2N2
Molecular Weight390.16 g/mol
Exact Mass388.01
IUPAC Name1-(2,5-dibromophenyl)-2,5-diethyl-5-methylpiperazine
SMILESCCC1CNC(C)(CC)CN1c1cc(Br)ccc1Br
InChIInChI=1S/C15H22Br2N2/c1-4-12-9-18-15(3,5-2)10-19(12)14-8-11(16)6-7-13(14)17/h6-8,12,18H,4-5,9-10H2,1-3H3
InChIKeyAKHBRKWKUPTYCA-UHFFFAOYSA-N
XLogP4.57
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 ≤ 54.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(5-bromo-2-methylphenyl)-2,5-diethyl-5-methylpiperazine
CID 64934365
1-(2-bromo-4-fluorophenyl)-2,5-diethyl-5-methylpiperazine
CID 64933561
1-(2,5-dichlorophenyl)-2,5-diethyl-5-methylpiperazine
CID 64935058
2,5-diethyl-1-(2-fluorophenyl)-5-methylpiperazine
CID 64932869
1-(4-bromo-3,5-dimethylphenyl)-2,5-diethyl-5-methylpiperazine
CID 107579892
2,5-diethyl-1-(5-fluoro-2-methylphenyl)-5-methylpiperazine
CID 64931265
1-(5-bromo-2-chlorophenyl)-2,5,5-triethylpiperazine
CID 64940782
1-(4-chloro-2-iodophenyl)-2,5-diethyl-5-methylpiperazine
CID 107640012
1-(5-bromo-2-methylphenyl)-5-ethyl-5-methyl-2-propan-2-ylpiperazine
CID 64933605
2,5-diethyl-5-methyl-1-thiophen-3-ylpiperazine
CID 66355426
1-(6-bromonaphthalen-2-yl)-5-ethyl-2,5-dimethylpiperazine
CID 81267340
2,5-diethyl-1-[2-(2-methoxyethyl)phenyl]-5-methylpiperazine
CID 102908460

Frequently Asked Questions

What is the IUPAC name of 1-(2,5-dibromophenyl)-2,5-diethyl-5-methylpiperazine?
The IUPAC name of 1-(2,5-dibromophenyl)-2,5-diethyl-5-methylpiperazine (CID 64933819) is 1-(2,5-dibromophenyl)-2,5-diethyl-5-methylpiperazine.
What is the SMILES notation for 1-(2,5-dibromophenyl)-2,5-diethyl-5-methylpiperazine?
The canonical SMILES for 1-(2,5-dibromophenyl)-2,5-diethyl-5-methylpiperazine is CCC1CNC(C)(CC)CN1c1cc(Br)ccc1Br.
What is the InChIKey of 1-(2,5-dibromophenyl)-2,5-diethyl-5-methylpiperazine?
The InChIKey is AKHBRKWKUPTYCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22Br2N2/c1-4-12-9-18-15(3,5-2)10-19(12)14-8-11(16)6-7-13(14)17/h6-8,12,18H,4-5,9-10H2,1-3H3.
What are the key properties of 1-(2,5-dibromophenyl)-2,5-diethyl-5-methylpiperazine?
1-(2,5-dibromophenyl)-2,5-diethyl-5-methylpiperazine has a molecular weight of 390.16 g/mol, XLogP of 4.57, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,5-dibromophenyl)-2,5-diethyl-5-methylpiperazine is sourced from PubChem (CID 64933819), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).