2-(2-bromo-3-fluorophenyl)-1-(4-bromo-2-methylphenyl)ethanamine

C15H14Br2FN — CID 105020445

IUPAC2-(2-bromo-3-fluorophenyl)-1-(4-bromo-2-methylphenyl)ethanamine
SMILESCc1cc(Br)ccc1C(N)Cc1cccc(F)c1Br
InChIInChI=1S/C15H14Br2FN/c1-9-7-11(16)5-6-12(9)14(19)8-10-3-2-4-13(18)15(10)17/h2-7,14H,8,19H2,1H3
InChIKeyLIIJSINLWIIXOV-UHFFFAOYSA-N
MW387.09 g/mol
LogP4.90
Rot. Bonds3

About 2-(2-bromo-3-fluorophenyl)-1-(4-bromo-2-methylphenyl)ethanamine

2-(2-bromo-3-fluorophenyl)-1-(4-bromo-2-methylphenyl)ethanamine (PubChem CID 105020445) has the molecular formula C15H14Br2FN and a molecular weight of 387.09 g/mol. Its IUPAC name is 2-(2-bromo-3-fluorophenyl)-1-(4-bromo-2-methylphenyl)ethanamine.

Molecular Properties

Compound Name2-(2-bromo-3-fluorophenyl)-1-(4-bromo-2-methylphenyl)ethanamine
PubChem CID105020445
Molecular FormulaC15H14Br2FN
Molecular Weight387.09 g/mol
Exact Mass384.95
IUPAC Name2-(2-bromo-3-fluorophenyl)-1-(4-bromo-2-methylphenyl)ethanamine
SMILESCc1cc(Br)ccc1C(N)Cc1cccc(F)c1Br
InChIInChI=1S/C15H14Br2FN/c1-9-7-11(16)5-6-12(9)14(19)8-10-3-2-4-13(18)15(10)17/h2-7,14H,8,19H2,1H3
InChIKeyLIIJSINLWIIXOV-UHFFFAOYSA-N
XLogP4.90
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500387.09
LogP ≤ 54.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-(2-bromo-3-fluorophenyl)-1-(2,4-dibromophenyl)ethanamine
CID 107946486
2-(2-bromo-3-fluorophenyl)-1-(2,6-dimethyl-3-pyridinyl)ethanamine
CID 105172090
2-(2-bromo-3-fluorophenyl)-1-(2,4-dichlorophenyl)ethanamine
CID 105020396
2-(5-bromo-2-fluorophenyl)-1-(4-fluoro-2-methylphenyl)ethanamine
CID 81279246
2-(2,3-difluorophenyl)-1-(4-fluoro-2-methylphenyl)ethanamine
CID 81279328
1-(4-bromo-2-fluorophenyl)-2-(2-fluorophenyl)ethanamine
CID 61078893
2-(2-bromo-3-fluorophenyl)-1-(2,4,6-trifluorophenyl)ethanamine
CID 105020643
1-(4-bromo-2-fluorophenyl)-2-(4-fluoro-2-methylphenyl)ethanamine
CID 114906223
2-(2-bromo-3-fluorophenyl)-1-(3-methoxy-4-methylphenyl)ethanamine
CID 105020500
2-(2-bromo-3-fluorophenyl)-1-(4-bromo-3-fluorophenyl)ethanamine
CID 105020699
2-(2-bromo-3-fluorophenyl)-1-(4-bromo-2-methoxyphenyl)ethanol
CID 115826418
1-(4-bromo-2-methylphenyl)-2-quinolin-4-ylethanamine
CID 104997339

Frequently Asked Questions

What is the IUPAC name of 2-(2-bromo-3-fluorophenyl)-1-(4-bromo-2-methylphenyl)ethanamine?
The IUPAC name of 2-(2-bromo-3-fluorophenyl)-1-(4-bromo-2-methylphenyl)ethanamine (CID 105020445) is 2-(2-bromo-3-fluorophenyl)-1-(4-bromo-2-methylphenyl)ethanamine.
What is the SMILES notation for 2-(2-bromo-3-fluorophenyl)-1-(4-bromo-2-methylphenyl)ethanamine?
The canonical SMILES for 2-(2-bromo-3-fluorophenyl)-1-(4-bromo-2-methylphenyl)ethanamine is Cc1cc(Br)ccc1C(N)Cc1cccc(F)c1Br.
What is the InChIKey of 2-(2-bromo-3-fluorophenyl)-1-(4-bromo-2-methylphenyl)ethanamine?
The InChIKey is LIIJSINLWIIXOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14Br2FN/c1-9-7-11(16)5-6-12(9)14(19)8-10-3-2-4-13(18)15(10)17/h2-7,14H,8,19H2,1H3.
What are the key properties of 2-(2-bromo-3-fluorophenyl)-1-(4-bromo-2-methylphenyl)ethanamine?
2-(2-bromo-3-fluorophenyl)-1-(4-bromo-2-methylphenyl)ethanamine has a molecular weight of 387.09 g/mol, XLogP of 4.90, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-bromo-3-fluorophenyl)-1-(4-bromo-2-methylphenyl)ethanamine is sourced from PubChem (CID 105020445), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).