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

C13H8Br3NO — CID 57379653

IUPAC2,5-dibromo-N-(2-bromophenyl)benzamide
SMILESO=C(Nc1ccccc1Br)c1cc(Br)ccc1Br
InChIInChI=1S/C13H8Br3NO/c14-8-5-6-10(15)9(7-8)13(18)17-12-4-2-1-3-11(12)16/h1-7H,(H,17,18)
InChIKeyRVAIBSXILRFSPK-UHFFFAOYSA-N
MW433.93 g/mol
LogP5.23
Rot. Bonds2

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

2,5-dibromo-N-(2-bromophenyl)benzamide (PubChem CID 57379653) has the molecular formula C13H8Br3NO and a molecular weight of 433.93 g/mol. Its IUPAC name is 2,5-dibromo-N-(2-bromophenyl)benzamide.

Molecular Properties

Compound Name2,5-dibromo-N-(2-bromophenyl)benzamide
PubChem CID57379653
Molecular FormulaC13H8Br3NO
Molecular Weight433.93 g/mol
Exact Mass430.82
IUPAC Name2,5-dibromo-N-(2-bromophenyl)benzamide
SMILESO=C(Nc1ccccc1Br)c1cc(Br)ccc1Br
InChIInChI=1S/C13H8Br3NO/c14-8-5-6-10(15)9(7-8)13(18)17-12-4-2-1-3-11(12)16/h1-7H,(H,17,18)
InChIKeyRVAIBSXILRFSPK-UHFFFAOYSA-N
XLogP5.23
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500433.93
LogP ≤ 55.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2,5-dibromo-N-(2-carbamothioylphenyl)benzamide
CID 114369521
3,5-dibromo-N-(2-bromophenyl)-2-iodobenzamide
CID 3465386
2,5-dibromo-N-(4-bromo-2,3-dichlorophenyl)benzamide
CID 107791014
N-(2,5-dibromophenyl)-2-methylbenzamide
CID 47167937
methyl 5-bromo-2-[(2-bromobenzoyl)amino]benzoate
CID 19168688
2,5-dibromo-N-(2-bromo-4-cyanophenyl)benzamide
CID 114371240
3,5-dibromo-N-(2-bromophenyl)benzamide
CID 107972328
2,5-dibromo-N-pyrimidin-2-ylbenzamide
CID 1234506
2,5-dibromo-N-(2,5-dimethylphenyl)benzamide
CID 114370020
5-bromo-2-fluoro-N-(2-fluorophenyl)benzamide
CID 24699182
5-bromo-2-methyl-N-(2-methylphenyl)benzamide
CID 65307068
2-[(2-bromobenzoyl)amino]-N-(4-bromophenyl)benzamide
CID 55358520

Frequently Asked Questions

What is the IUPAC name of 2,5-dibromo-N-(2-bromophenyl)benzamide?
The IUPAC name of 2,5-dibromo-N-(2-bromophenyl)benzamide (CID 57379653) is 2,5-dibromo-N-(2-bromophenyl)benzamide.
What is the SMILES notation for 2,5-dibromo-N-(2-bromophenyl)benzamide?
The canonical SMILES for 2,5-dibromo-N-(2-bromophenyl)benzamide is O=C(Nc1ccccc1Br)c1cc(Br)ccc1Br.
What is the InChIKey of 2,5-dibromo-N-(2-bromophenyl)benzamide?
The InChIKey is RVAIBSXILRFSPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H8Br3NO/c14-8-5-6-10(15)9(7-8)13(18)17-12-4-2-1-3-11(12)16/h1-7H,(H,17,18).
What are the key properties of 2,5-dibromo-N-(2-bromophenyl)benzamide?
2,5-dibromo-N-(2-bromophenyl)benzamide has a molecular weight of 433.93 g/mol, XLogP of 5.23, 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)benzamide is sourced from PubChem (CID 57379653), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).