1-(4-bromophenoxy)-1-(2-bromophenyl)propan-2-amine

C15H15Br2NO — CID 55022646

IUPAC1-(4-bromophenoxy)-1-(2-bromophenyl)propan-2-amine
SMILESCC(N)C(Oc1ccc(Br)cc1)c1ccccc1Br
InChIInChI=1S/C15H15Br2NO/c1-10(18)15(13-4-2-3-5-14(13)17)19-12-8-6-11(16)7-9-12/h2-10,15H,18H2,1H3
InChIKeyFZDBFPIDGLMOLP-UHFFFAOYSA-N
MW385.10 g/mol
LogP4.68
Rot. Bonds4

About 1-(4-bromophenoxy)-1-(2-bromophenyl)propan-2-amine

1-(4-bromophenoxy)-1-(2-bromophenyl)propan-2-amine (PubChem CID 55022646) has the molecular formula C15H15Br2NO and a molecular weight of 385.10 g/mol. Its IUPAC name is 1-(4-bromophenoxy)-1-(2-bromophenyl)propan-2-amine.

Molecular Properties

Compound Name1-(4-bromophenoxy)-1-(2-bromophenyl)propan-2-amine
PubChem CID55022646
Molecular FormulaC15H15Br2NO
Molecular Weight385.10 g/mol
Exact Mass382.95
IUPAC Name1-(4-bromophenoxy)-1-(2-bromophenyl)propan-2-amine
SMILESCC(N)C(Oc1ccc(Br)cc1)c1ccccc1Br
InChIInChI=1S/C15H15Br2NO/c1-10(18)15(13-4-2-3-5-14(13)17)19-12-8-6-11(16)7-9-12/h2-10,15H,18H2,1H3
InChIKeyFZDBFPIDGLMOLP-UHFFFAOYSA-N
XLogP4.68
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 ≤ 54.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(3-bromo-4-fluorophenoxy)-1-(2-bromophenyl)propan-2-amine
CID 83232003
1-(2-bromophenyl)-1-(3-fluorophenoxy)propan-2-amine
CID 55023034
1-(2-bromophenyl)-1-(3-ethoxyphenoxy)propan-2-amine
CID 62337254
2-[2-[2-amino-1-(2-bromophenyl)propoxy]phenyl]ethanol
CID 107712113
1-(4-bromophenoxy)-1-(2-chlorophenyl)butan-2-amine
CID 63458294
1-(2-chlorophenyl)-1-(4-fluorophenoxy)propan-2-amine
CID 55022666
4-[(1R,2S)-2-amino-1-(4-bromophenyl)propoxy]benzoic acid
CID 126713985
1-(2-methoxyphenyl)-1-(4-methylsulfanylphenoxy)propan-2-amine
CID 63648489
1-(3,5-dichlorophenoxy)-1-(2-methylphenyl)propan-2-amine
CID 63461961
1-(3,5-difluorophenoxy)-1-(2-fluorophenyl)propan-2-amine
CID 62785959
1-(3-bromo-5-fluorophenoxy)-1-(2-bromophenyl)butan-2-amine
CID 81315466
1-(2-bromophenyl)-1-fluoropropan-2-amine
CID 105490419

Frequently Asked Questions

What is the IUPAC name of 1-(4-bromophenoxy)-1-(2-bromophenyl)propan-2-amine?
The IUPAC name of 1-(4-bromophenoxy)-1-(2-bromophenyl)propan-2-amine (CID 55022646) is 1-(4-bromophenoxy)-1-(2-bromophenyl)propan-2-amine.
What is the SMILES notation for 1-(4-bromophenoxy)-1-(2-bromophenyl)propan-2-amine?
The canonical SMILES for 1-(4-bromophenoxy)-1-(2-bromophenyl)propan-2-amine is CC(N)C(Oc1ccc(Br)cc1)c1ccccc1Br.
What is the InChIKey of 1-(4-bromophenoxy)-1-(2-bromophenyl)propan-2-amine?
The InChIKey is FZDBFPIDGLMOLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15Br2NO/c1-10(18)15(13-4-2-3-5-14(13)17)19-12-8-6-11(16)7-9-12/h2-10,15H,18H2,1H3.
What are the key properties of 1-(4-bromophenoxy)-1-(2-bromophenyl)propan-2-amine?
1-(4-bromophenoxy)-1-(2-bromophenyl)propan-2-amine has a molecular weight of 385.10 g/mol, XLogP of 4.68, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-bromophenoxy)-1-(2-bromophenyl)propan-2-amine is sourced from PubChem (CID 55022646), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).