2-(2-bromo-5-fluorophenyl)-1-(5-bromo-2-fluorophenyl)ethanamine

C14H11Br2F2N — CID 114894635

IUPAC2-(2-bromo-5-fluorophenyl)-1-(5-bromo-2-fluorophenyl)ethanamine
SMILESNC(Cc1cc(F)ccc1Br)c1cc(Br)ccc1F
InChIInChI=1S/C14H11Br2F2N/c15-9-1-4-13(18)11(7-9)14(19)6-8-5-10(17)2-3-12(8)16/h1-5,7,14H,6,19H2
InChIKeyKSWJCMIDHNXJLX-UHFFFAOYSA-N
MW391.05 g/mol
LogP4.73
Rot. Bonds3

About 2-(2-bromo-5-fluorophenyl)-1-(5-bromo-2-fluorophenyl)ethanamine

2-(2-bromo-5-fluorophenyl)-1-(5-bromo-2-fluorophenyl)ethanamine (PubChem CID 114894635) has the molecular formula C14H11Br2F2N and a molecular weight of 391.05 g/mol. Its IUPAC name is 2-(2-bromo-5-fluorophenyl)-1-(5-bromo-2-fluorophenyl)ethanamine.

Molecular Properties

Compound Name2-(2-bromo-5-fluorophenyl)-1-(5-bromo-2-fluorophenyl)ethanamine
PubChem CID114894635
Molecular FormulaC14H11Br2F2N
Molecular Weight391.05 g/mol
Exact Mass388.92
IUPAC Name2-(2-bromo-5-fluorophenyl)-1-(5-bromo-2-fluorophenyl)ethanamine
SMILESNC(Cc1cc(F)ccc1Br)c1cc(Br)ccc1F
InChIInChI=1S/C14H11Br2F2N/c15-9-1-4-13(18)11(7-9)14(19)6-8-5-10(17)2-3-12(8)16/h1-5,7,14H,6,19H2
InChIKeyKSWJCMIDHNXJLX-UHFFFAOYSA-N
XLogP4.73
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500391.05
LogP ≤ 54.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-(5-bromo-2-fluorophenyl)-2-(5-fluoro-2-methylphenyl)ethanamine
CID 105374445
1-(4-bromo-2-chlorophenyl)-2-(2-bromo-5-fluorophenyl)ethanamine
CID 115843665
1-(5-bromo-2-fluorophenyl)-2-(4-chloro-2-fluorophenyl)ethanamine
CID 114894465
2-(2-bromo-5-fluorophenyl)-1-(2,4,6-trifluorophenyl)ethanamine
CID 115843812
1-(5-bromo-2-methylphenyl)-2-(5-fluoro-2-methylphenyl)ethanamine
CID 105377378
2-(2-bromo-5-fluorophenyl)-1-(2-methylphenyl)ethanamine
CID 62600298
2-(2-bromo-5-fluorophenyl)-1-(2,5-dibromothiophen-3-yl)ethanamine
CID 114022096
1-(5-chloro-2-fluorophenyl)-2-(2,5-difluorophenyl)ethanamine
CID 114885798
1-(3-bromo-2-chlorophenyl)-2-(2-bromo-5-fluorophenyl)ethanamine
CID 115843513
2-(2-bromo-5-fluorophenyl)-1-(3-chloro-4-fluorophenyl)ethanamine
CID 63094668
1-(2-amino-5-bromophenyl)-2-(2-bromo-5-fluorophenyl)ethanol
CID 82703485
2-(5-bromo-2-fluorophenyl)-1-(4-fluoro-2-methylphenyl)ethanamine
CID 81279246

Frequently Asked Questions

What is the IUPAC name of 2-(2-bromo-5-fluorophenyl)-1-(5-bromo-2-fluorophenyl)ethanamine?
The IUPAC name of 2-(2-bromo-5-fluorophenyl)-1-(5-bromo-2-fluorophenyl)ethanamine (CID 114894635) is 2-(2-bromo-5-fluorophenyl)-1-(5-bromo-2-fluorophenyl)ethanamine.
What is the SMILES notation for 2-(2-bromo-5-fluorophenyl)-1-(5-bromo-2-fluorophenyl)ethanamine?
The canonical SMILES for 2-(2-bromo-5-fluorophenyl)-1-(5-bromo-2-fluorophenyl)ethanamine is NC(Cc1cc(F)ccc1Br)c1cc(Br)ccc1F.
What is the InChIKey of 2-(2-bromo-5-fluorophenyl)-1-(5-bromo-2-fluorophenyl)ethanamine?
The InChIKey is KSWJCMIDHNXJLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11Br2F2N/c15-9-1-4-13(18)11(7-9)14(19)6-8-5-10(17)2-3-12(8)16/h1-5,7,14H,6,19H2.
What are the key properties of 2-(2-bromo-5-fluorophenyl)-1-(5-bromo-2-fluorophenyl)ethanamine?
2-(2-bromo-5-fluorophenyl)-1-(5-bromo-2-fluorophenyl)ethanamine has a molecular weight of 391.05 g/mol, XLogP of 4.73, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-bromo-5-fluorophenyl)-1-(5-bromo-2-fluorophenyl)ethanamine is sourced from PubChem (CID 114894635), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).