1-(2,5-dibromophenyl)-2-(2-methylphenyl)ethanamine

C15H15Br2N — CID 43109344

IUPAC1-(2,5-dibromophenyl)-2-(2-methylphenyl)ethanamine
SMILESCc1ccccc1CC(N)c1cc(Br)ccc1Br
InChIInChI=1S/C15H15Br2N/c1-10-4-2-3-5-11(10)8-15(18)13-9-12(16)6-7-14(13)17/h2-7,9,15H,8,18H2,1H3
InChIKeySHDRKAOYJNEJGO-UHFFFAOYSA-N
MW369.10 g/mol
LogP4.76
Rot. Bonds3

About 1-(2,5-dibromophenyl)-2-(2-methylphenyl)ethanamine

1-(2,5-dibromophenyl)-2-(2-methylphenyl)ethanamine (PubChem CID 43109344) has the molecular formula C15H15Br2N and a molecular weight of 369.10 g/mol. Its IUPAC name is 1-(2,5-dibromophenyl)-2-(2-methylphenyl)ethanamine.

Molecular Properties

Compound Name1-(2,5-dibromophenyl)-2-(2-methylphenyl)ethanamine
PubChem CID43109344
Molecular FormulaC15H15Br2N
Molecular Weight369.10 g/mol
Exact Mass366.96
IUPAC Name1-(2,5-dibromophenyl)-2-(2-methylphenyl)ethanamine
SMILESCc1ccccc1CC(N)c1cc(Br)ccc1Br
InChIInChI=1S/C15H15Br2N/c1-10-4-2-3-5-11(10)8-15(18)13-9-12(16)6-7-14(13)17/h2-7,9,15H,8,18H2,1H3
InChIKeySHDRKAOYJNEJGO-UHFFFAOYSA-N
XLogP4.76
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.10
LogP ≤ 54.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-(2-bromo-4,5-dimethoxyphenyl)-2-(2-methylphenyl)ethanamine
CID 43118218
1-(5-bromo-2-methylphenyl)-2-(5-fluoro-2-methylphenyl)ethanamine
CID 105377378
2-(2-bromo-5-fluorophenyl)-1-(2-methylphenyl)ethanamine
CID 62600298
1-(5-bromo-2-fluorophenyl)-2-(5-fluoro-2-methylphenyl)ethanamine
CID 105374445
1-(2,5-dibromophenyl)-2-(5-ethylthiophen-2-yl)ethanamine
CID 115842771
4-bromo-1-chloro-2-[1-chloro-2-(2-methylphenyl)ethyl]benzene
CID 55224259
1-(3-bromo-2,6-difluorophenyl)-2-(2-methylphenyl)ethanamine
CID 106942346
1-(5-bromo-2-iodophenyl)-2-(2-methylphenyl)ethanol
CID 114033074
1-(2,5-dibromophenyl)-2-(4-propan-2-ylphenyl)ethanamine
CID 115844387
2-(4-tert-butylphenyl)-1-(2,5-dibromophenyl)ethanamine
CID 115842956
(1R)-1-(2,5-dibromophenyl)-2-fluoroethanamine;hydrochloride
CID 171235024
(1S)-1-(2,5-dibromophenyl)-3-methylbut-3-en-1-amine;hydrochloride
CID 171235050

Frequently Asked Questions

What is the IUPAC name of 1-(2,5-dibromophenyl)-2-(2-methylphenyl)ethanamine?
The IUPAC name of 1-(2,5-dibromophenyl)-2-(2-methylphenyl)ethanamine (CID 43109344) is 1-(2,5-dibromophenyl)-2-(2-methylphenyl)ethanamine.
What is the SMILES notation for 1-(2,5-dibromophenyl)-2-(2-methylphenyl)ethanamine?
The canonical SMILES for 1-(2,5-dibromophenyl)-2-(2-methylphenyl)ethanamine is Cc1ccccc1CC(N)c1cc(Br)ccc1Br.
What is the InChIKey of 1-(2,5-dibromophenyl)-2-(2-methylphenyl)ethanamine?
The InChIKey is SHDRKAOYJNEJGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15Br2N/c1-10-4-2-3-5-11(10)8-15(18)13-9-12(16)6-7-14(13)17/h2-7,9,15H,8,18H2,1H3.
What are the key properties of 1-(2,5-dibromophenyl)-2-(2-methylphenyl)ethanamine?
1-(2,5-dibromophenyl)-2-(2-methylphenyl)ethanamine has a molecular weight of 369.10 g/mol, XLogP of 4.76, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,5-dibromophenyl)-2-(2-methylphenyl)ethanamine is sourced from PubChem (CID 43109344), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).