2-(2,2-dibromoethenyl)benzamide

C9H7Br2NO — CID 10470333

IUPAC2-(2,2-dibromoethenyl)benzamide
SMILESNC(=O)c1ccccc1C=C(Br)Br
InChIInChI=1S/C9H7Br2NO/c10-8(11)5-6-3-1-2-4-7(6)9(12)13/h1-5H,(H2,12,13)
InChIKeyQHYNAFIZOQORAY-UHFFFAOYSA-N
MW304.97 g/mol
LogP2.87
Rot. Bonds2

About 2-(2,2-dibromoethenyl)benzamide

2-(2,2-dibromoethenyl)benzamide (PubChem CID 10470333) has the molecular formula C9H7Br2NO and a molecular weight of 304.97 g/mol. Its IUPAC name is 2-(2,2-dibromoethenyl)benzamide.

Molecular Properties

Compound Name2-(2,2-dibromoethenyl)benzamide
PubChem CID10470333
Molecular FormulaC9H7Br2NO
Molecular Weight304.97 g/mol
Exact Mass302.89
IUPAC Name2-(2,2-dibromoethenyl)benzamide
SMILESNC(=O)c1ccccc1C=C(Br)Br
InChIInChI=1S/C9H7Br2NO/c10-8(11)5-6-3-1-2-4-7(6)9(12)13/h1-5H,(H2,12,13)
InChIKeyQHYNAFIZOQORAY-UHFFFAOYSA-N
XLogP2.87
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.97
LogP ≤ 52.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

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benzene-1,2-dicarboxamide;hydrazine
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2-[(E)-3,3,3-trifluoroprop-1-enyl]benzamide
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2-(2-cyanoethenyl)benzamide
CID 131884772
bis(2-aminobenzamide);platinum(2+)
CID 50912239
2-bromobenzamide;hydrochloride
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3-[2-(2-aminobenzoyl)phenyl]-2-methylprop-2-enamide
CID 73431531
(E)-3-[2-(2-aminobenzoyl)phenyl]-2-methylprop-2-enamide
CID 18348022
benzene;2-hydroxybenzamide
CID 157085280
2-oxaldehydoylbenzamide
CID 146295366

Frequently Asked Questions

What is the IUPAC name of 2-(2,2-dibromoethenyl)benzamide?
The IUPAC name of 2-(2,2-dibromoethenyl)benzamide (CID 10470333) is 2-(2,2-dibromoethenyl)benzamide.
What is the SMILES notation for 2-(2,2-dibromoethenyl)benzamide?
The canonical SMILES for 2-(2,2-dibromoethenyl)benzamide is NC(=O)c1ccccc1C=C(Br)Br.
What is the InChIKey of 2-(2,2-dibromoethenyl)benzamide?
The InChIKey is QHYNAFIZOQORAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H7Br2NO/c10-8(11)5-6-3-1-2-4-7(6)9(12)13/h1-5H,(H2,12,13).
What are the key properties of 2-(2,2-dibromoethenyl)benzamide?
2-(2,2-dibromoethenyl)benzamide has a molecular weight of 304.97 g/mol, XLogP of 2.87, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,2-dibromoethenyl)benzamide is sourced from PubChem (CID 10470333), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).