2,5-dibromo-N-(2-bromophenyl)aniline

C12H8Br3N — CID 101290775

IUPAC2,5-dibromo-N-(2-bromophenyl)aniline
SMILESBrc1ccc(Br)c(Nc2ccccc2Br)c1
InChIInChI=1S/C12H8Br3N/c13-8-5-6-10(15)12(7-8)16-11-4-2-1-3-9(11)14/h1-7,16H
InChIKeyAXVWBPXLDUBAPM-UHFFFAOYSA-N
MW405.92 g/mol
LogP5.72
Rot. Bonds2

About 2,5-dibromo-N-(2-bromophenyl)aniline

2,5-dibromo-N-(2-bromophenyl)aniline (PubChem CID 101290775) has the molecular formula C12H8Br3N and a molecular weight of 405.92 g/mol. Its IUPAC name is 2,5-dibromo-N-(2-bromophenyl)aniline.

Molecular Properties

Compound Name2,5-dibromo-N-(2-bromophenyl)aniline
PubChem CID101290775
Molecular FormulaC12H8Br3N
Molecular Weight405.92 g/mol
Exact Mass402.82
IUPAC Name2,5-dibromo-N-(2-bromophenyl)aniline
SMILESBrc1ccc(Br)c(Nc2ccccc2Br)c1
InChIInChI=1S/C12H8Br3N/c13-8-5-6-10(15)12(7-8)16-11-4-2-1-3-9(11)14/h1-7,16H
InChIKeyAXVWBPXLDUBAPM-UHFFFAOYSA-N
XLogP5.72
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500405.92
LogP ≤ 55.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

3,4-dibromo-N-(2-bromophenyl)aniline
CID 101290777
N-(2-bromophenyl)-2-chloroaniline
CID 14022259
2-amino-3-(2,5-dibromoanilino)benzoic acid
CID 113332723
2,5-dibromo-N-(2-bromophenyl)benzamide
CID 57379653
2-N-(2,5-dibromophenyl)-4-fluorobenzene-1,2-diamine
CID 55067874
2,6-dibromo-N-(2,4-dibromophenyl)aniline
CID 101290135
1,2-bis(2-bromophenyl)hydrazine
CID 139124202
methyl 2-amino-3-(2,5-dibromoanilino)benzoate
CID 115545220
3-(2,5-dibromoanilino)-2-nitrobenzoic acid
CID 115542274
6-chloro-N-(2,5-dibromophenyl)pyridin-2-amine
CID 63588218
6-N-(2,5-dibromophenyl)pyridine-2,6-diamine
CID 80652280
5-bromo-N-(2,5-dibromophenyl)pyridin-3-amine
CID 104531609

Frequently Asked Questions

What is the IUPAC name of 2,5-dibromo-N-(2-bromophenyl)aniline?
The IUPAC name of 2,5-dibromo-N-(2-bromophenyl)aniline (CID 101290775) is 2,5-dibromo-N-(2-bromophenyl)aniline.
What is the SMILES notation for 2,5-dibromo-N-(2-bromophenyl)aniline?
The canonical SMILES for 2,5-dibromo-N-(2-bromophenyl)aniline is Brc1ccc(Br)c(Nc2ccccc2Br)c1.
What is the InChIKey of 2,5-dibromo-N-(2-bromophenyl)aniline?
The InChIKey is AXVWBPXLDUBAPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H8Br3N/c13-8-5-6-10(15)12(7-8)16-11-4-2-1-3-9(11)14/h1-7,16H.
What are the key properties of 2,5-dibromo-N-(2-bromophenyl)aniline?
2,5-dibromo-N-(2-bromophenyl)aniline has a molecular weight of 405.92 g/mol, XLogP of 5.72, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dibromo-N-(2-bromophenyl)aniline is sourced from PubChem (CID 101290775), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).