2-(2,4-dibromophenoxy)-2-(2-methylphenyl)ethanamine

C15H15Br2NO — CID 64721518

IUPAC2-(2,4-dibromophenoxy)-2-(2-methylphenyl)ethanamine
SMILESCc1ccccc1C(CN)Oc1ccc(Br)cc1Br
InChIInChI=1S/C15H15Br2NO/c1-10-4-2-3-5-12(10)15(9-18)19-14-7-6-11(16)8-13(14)17/h2-8,15H,9,18H2,1H3
InChIKeyDJUYTWHASIGJNL-UHFFFAOYSA-N
MW385.10 g/mol
LogP4.60
Rot. Bonds4

About 2-(2,4-dibromophenoxy)-2-(2-methylphenyl)ethanamine

2-(2,4-dibromophenoxy)-2-(2-methylphenyl)ethanamine (PubChem CID 64721518) has the molecular formula C15H15Br2NO and a molecular weight of 385.10 g/mol. Its IUPAC name is 2-(2,4-dibromophenoxy)-2-(2-methylphenyl)ethanamine.

Molecular Properties

Compound Name2-(2,4-dibromophenoxy)-2-(2-methylphenyl)ethanamine
PubChem CID64721518
Molecular FormulaC15H15Br2NO
Molecular Weight385.10 g/mol
Exact Mass382.95
IUPAC Name2-(2,4-dibromophenoxy)-2-(2-methylphenyl)ethanamine
SMILESCc1ccccc1C(CN)Oc1ccc(Br)cc1Br
InChIInChI=1S/C15H15Br2NO/c1-10-4-2-3-5-12(10)15(9-18)19-14-7-6-11(16)8-13(14)17/h2-8,15H,9,18H2,1H3
InChIKeyDJUYTWHASIGJNL-UHFFFAOYSA-N
XLogP4.60
TPSA35.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500385.10
LogP ≤ 54.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(4-bromo-2-fluorophenoxy)-2-(2-fluorophenyl)ethanamine
CID 55019182
2-(2-bromo-4-methoxyphenoxy)-2-(2-fluorophenyl)ethanamine
CID 104706806
2-(4-bromo-2-methylphenoxy)-2-(4-bromophenyl)ethanamine
CID 55191488
2-[2-amino-1-(2-methylphenyl)ethoxy]benzonitrile
CID 55018955
2-(2,3-dichlorophenoxy)-2-(2-methylphenyl)ethanamine
CID 55018621
2-(4-bromo-3,5-dimethylphenoxy)-2-(2-bromophenyl)ethanamine
CID 107722774
2-(2-bromophenoxy)-2-(2-chlorophenyl)ethanamine
CID 55022574
2-(2-bromophenoxy)-2-(2-fluorophenyl)ethanamine
CID 55019037
2-(2-bromophenyl)-2-(3,5-dimethylphenoxy)ethanamine
CID 55022743
2-(4-bromo-2-propan-2-ylphenoxy)-2-pyridin-2-ylethanamine
CID 115401604
3-(2-methylphenoxy)-3-(2-methylphenyl)propan-1-amine
CID 67124192
2-(4-bromo-2-propan-2-ylphenoxy)-2-thiophen-2-ylethanamine
CID 115401637

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-dibromophenoxy)-2-(2-methylphenyl)ethanamine?
The IUPAC name of 2-(2,4-dibromophenoxy)-2-(2-methylphenyl)ethanamine (CID 64721518) is 2-(2,4-dibromophenoxy)-2-(2-methylphenyl)ethanamine.
What is the SMILES notation for 2-(2,4-dibromophenoxy)-2-(2-methylphenyl)ethanamine?
The canonical SMILES for 2-(2,4-dibromophenoxy)-2-(2-methylphenyl)ethanamine is Cc1ccccc1C(CN)Oc1ccc(Br)cc1Br.
What is the InChIKey of 2-(2,4-dibromophenoxy)-2-(2-methylphenyl)ethanamine?
The InChIKey is DJUYTWHASIGJNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15Br2NO/c1-10-4-2-3-5-12(10)15(9-18)19-14-7-6-11(16)8-13(14)17/h2-8,15H,9,18H2,1H3.
What are the key properties of 2-(2,4-dibromophenoxy)-2-(2-methylphenyl)ethanamine?
2-(2,4-dibromophenoxy)-2-(2-methylphenyl)ethanamine has a molecular weight of 385.10 g/mol, XLogP of 4.60, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-dibromophenoxy)-2-(2-methylphenyl)ethanamine is sourced from PubChem (CID 64721518), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).