1-(2,4-dibromophenyl)-5,5-dimethyl-2-propan-2-ylpiperazine

C15H22Br2N2 — CID 64946247

IUPAC1-(2,4-dibromophenyl)-5,5-dimethyl-2-propan-2-ylpiperazine
SMILESCC(C)C1CNC(C)(C)CN1c1ccc(Br)cc1Br
InChIInChI=1S/C15H22Br2N2/c1-10(2)14-8-18-15(3,4)9-19(14)13-6-5-11(16)7-12(13)17/h5-7,10,14,18H,8-9H2,1-4H3
InChIKeyNXIFKEQVMZKBKU-UHFFFAOYSA-N
MW390.16 g/mol
LogP4.42
Rot. Bonds2

About 1-(2,4-dibromophenyl)-5,5-dimethyl-2-propan-2-ylpiperazine

1-(2,4-dibromophenyl)-5,5-dimethyl-2-propan-2-ylpiperazine (PubChem CID 64946247) has the molecular formula C15H22Br2N2 and a molecular weight of 390.16 g/mol. Its IUPAC name is 1-(2,4-dibromophenyl)-5,5-dimethyl-2-propan-2-ylpiperazine.

Molecular Properties

Compound Name1-(2,4-dibromophenyl)-5,5-dimethyl-2-propan-2-ylpiperazine
PubChem CID64946247
Molecular FormulaC15H22Br2N2
Molecular Weight390.16 g/mol
Exact Mass388.01
IUPAC Name1-(2,4-dibromophenyl)-5,5-dimethyl-2-propan-2-ylpiperazine
SMILESCC(C)C1CNC(C)(C)CN1c1ccc(Br)cc1Br
InChIInChI=1S/C15H22Br2N2/c1-10(2)14-8-18-15(3,4)9-19(14)13-6-5-11(16)7-12(13)17/h5-7,10,14,18H,8-9H2,1-4H3
InChIKeyNXIFKEQVMZKBKU-UHFFFAOYSA-N
XLogP4.42
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
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-(2,4-dimethylphenyl)-5,5-dimethyl-2-propan-2-ylpiperazine
CID 64930665
1-(4-bromo-3-methylphenyl)-5,5-dimethyl-2-propan-2-ylpiperazine
CID 64935073
1-(2,4-dibromophenyl)-5-methyl-2-propan-2-ylpiperazine
CID 64937159
1-(4-methoxy-2-methylphenyl)-5,5-dimethyl-2-propan-2-ylpiperazine
CID 64941938
5,5-dimethyl-2-propan-2-yl-1-(2,4,5-trichlorophenyl)piperazine
CID 64934504
1-(5-bromo-2-methylphenyl)-5-ethyl-5-methyl-2-propan-2-ylpiperazine
CID 64933605
1-(3,4-dichlorophenyl)-5,5-dimethyl-2-propan-2-ylpiperazine
CID 64935824
5,5-dimethyl-1-naphthalen-2-yl-2-propan-2-ylpiperazine
CID 64945583
1-(5-bromo-2-chlorophenyl)-5,5-diethyl-2-propan-2-ylpiperazine
CID 64942138
1-(3-chloro-2-fluorophenyl)-5,5-dimethyl-2-propan-2-ylpiperazine
CID 64935490
1-(4-methoxyphenyl)-5,5-dimethyl-2-propan-2-ylpiperazine
CID 64932532
1-(1,3-dimethylpyrazol-4-yl)-5,5-dimethyl-2-propan-2-ylpiperazine
CID 102807519

Frequently Asked Questions

What is the IUPAC name of 1-(2,4-dibromophenyl)-5,5-dimethyl-2-propan-2-ylpiperazine?
The IUPAC name of 1-(2,4-dibromophenyl)-5,5-dimethyl-2-propan-2-ylpiperazine (CID 64946247) is 1-(2,4-dibromophenyl)-5,5-dimethyl-2-propan-2-ylpiperazine.
What is the SMILES notation for 1-(2,4-dibromophenyl)-5,5-dimethyl-2-propan-2-ylpiperazine?
The canonical SMILES for 1-(2,4-dibromophenyl)-5,5-dimethyl-2-propan-2-ylpiperazine is CC(C)C1CNC(C)(C)CN1c1ccc(Br)cc1Br.
What is the InChIKey of 1-(2,4-dibromophenyl)-5,5-dimethyl-2-propan-2-ylpiperazine?
The InChIKey is NXIFKEQVMZKBKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22Br2N2/c1-10(2)14-8-18-15(3,4)9-19(14)13-6-5-11(16)7-12(13)17/h5-7,10,14,18H,8-9H2,1-4H3.
What are the key properties of 1-(2,4-dibromophenyl)-5,5-dimethyl-2-propan-2-ylpiperazine?
1-(2,4-dibromophenyl)-5,5-dimethyl-2-propan-2-ylpiperazine has a molecular weight of 390.16 g/mol, XLogP of 4.42, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,4-dibromophenyl)-5,5-dimethyl-2-propan-2-ylpiperazine is sourced from PubChem (CID 64946247), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).