1-(2,4-dibromophenyl)-2-methyl-5-(2-methylpropyl)piperazine

C15H22Br2N2 — CID 64946822

IUPAC1-(2,4-dibromophenyl)-2-methyl-5-(2-methylpropyl)piperazine
SMILESCC(C)CC1CN(c2ccc(Br)cc2Br)C(C)CN1
InChIInChI=1S/C15H22Br2N2/c1-10(2)6-13-9-19(11(3)8-18-13)15-5-4-12(16)7-14(15)17/h4-5,7,10-11,13,18H,6,8-9H2,1-3H3
InChIKeyFYRRZNUUIVCRTG-UHFFFAOYSA-N
MW390.16 g/mol
LogP4.42
Rot. Bonds3

About 1-(2,4-dibromophenyl)-2-methyl-5-(2-methylpropyl)piperazine

1-(2,4-dibromophenyl)-2-methyl-5-(2-methylpropyl)piperazine (PubChem CID 64946822) has the molecular formula C15H22Br2N2 and a molecular weight of 390.16 g/mol. Its IUPAC name is 1-(2,4-dibromophenyl)-2-methyl-5-(2-methylpropyl)piperazine.

Molecular Properties

Compound Name1-(2,4-dibromophenyl)-2-methyl-5-(2-methylpropyl)piperazine
PubChem CID64946822
Molecular FormulaC15H22Br2N2
Molecular Weight390.16 g/mol
Exact Mass388.01
IUPAC Name1-(2,4-dibromophenyl)-2-methyl-5-(2-methylpropyl)piperazine
SMILESCC(C)CC1CN(c2ccc(Br)cc2Br)C(C)CN1
InChIInChI=1S/C15H22Br2N2/c1-10(2)6-13-9-19(11(3)8-18-13)15-5-4-12(16)7-14(15)17/h4-5,7,10-11,13,18H,6,8-9H2,1-3H3
InChIKeyFYRRZNUUIVCRTG-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-(4-Bromophenyl)-4-methylpiperazine
CID 11817675
N-(4-bromophenyl)-N',N'-diethylpropane-1,3-diamine
CID 44399278
N-(2-bromophenyl)-N',N'-diethylpropane-1,3-diamine
CID 44399494
1-(4-Bromophenyl)piperazine
CID 2735629
1-(3-Bromophenyl)piperazine
CID 2757154
N-(2-bromophenyl)piperidin-4-amine
CID 56923529
4-(4-Bromophenyl)-1,1-diethylpiperazin-1-ium iodide
CID 127039018
1-(2-Bromophenyl)piperazine
CID 2757153
5-Bromo-2-(4-methylpiperazin-1-yl)aniline
CID 4961872
1-(4-Bromophenyl)piperazine hydrochloride
CID 14422838
(4-Bromophenyl)isopropylamine hydrobromide
CID 75531503
2-bromo-N-(2-piperidin-1-ylethyl)aniline;hydrochloride
CID 137649623

Frequently Asked Questions

What is the IUPAC name of 1-(2,4-dibromophenyl)-2-methyl-5-(2-methylpropyl)piperazine?
The IUPAC name of 1-(2,4-dibromophenyl)-2-methyl-5-(2-methylpropyl)piperazine (CID 64946822) is 1-(2,4-dibromophenyl)-2-methyl-5-(2-methylpropyl)piperazine.
What is the SMILES notation for 1-(2,4-dibromophenyl)-2-methyl-5-(2-methylpropyl)piperazine?
The canonical SMILES for 1-(2,4-dibromophenyl)-2-methyl-5-(2-methylpropyl)piperazine is CC(C)CC1CN(c2ccc(Br)cc2Br)C(C)CN1.
What is the InChIKey of 1-(2,4-dibromophenyl)-2-methyl-5-(2-methylpropyl)piperazine?
The InChIKey is FYRRZNUUIVCRTG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22Br2N2/c1-10(2)6-13-9-19(11(3)8-18-13)15-5-4-12(16)7-14(15)17/h4-5,7,10-11,13,18H,6,8-9H2,1-3H3.
What are the key properties of 1-(2,4-dibromophenyl)-2-methyl-5-(2-methylpropyl)piperazine?
1-(2,4-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-(2,4-dibromophenyl)-2-methyl-5-(2-methylpropyl)piperazine is sourced from PubChem (CID 64946822), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).