2-bromo-N-[2-(3-bromobenzoyl)phenyl]acetamide

C15H11Br2NO2 — CID 150212976

IUPAC2-bromo-N-[2-(3-bromobenzoyl)phenyl]acetamide
SMILESO=C(CBr)Nc1ccccc1C(=O)c1cccc(Br)c1
InChIInChI=1S/C15H11Br2NO2/c16-9-14(19)18-13-7-2-1-6-12(13)15(20)10-4-3-5-11(17)8-10/h1-8H,9H2,(H,18,19)
InChIKeyFRWNGGCJAQQOAT-UHFFFAOYSA-N
MW397.07 g/mol
LogP4.01
Rot. Bonds4

About 2-bromo-N-[2-(3-bromobenzoyl)phenyl]acetamide

2-bromo-N-[2-(3-bromobenzoyl)phenyl]acetamide (PubChem CID 150212976) has the molecular formula C15H11Br2NO2 and a molecular weight of 397.07 g/mol. Its IUPAC name is 2-bromo-N-[2-(3-bromobenzoyl)phenyl]acetamide.

Molecular Properties

Compound Name2-bromo-N-[2-(3-bromobenzoyl)phenyl]acetamide
PubChem CID150212976
Molecular FormulaC15H11Br2NO2
Molecular Weight397.07 g/mol
Exact Mass394.92
IUPAC Name2-bromo-N-[2-(3-bromobenzoyl)phenyl]acetamide
SMILESO=C(CBr)Nc1ccccc1C(=O)c1cccc(Br)c1
InChIInChI=1S/C15H11Br2NO2/c16-9-14(19)18-13-7-2-1-6-12(13)15(20)10-4-3-5-11(17)8-10/h1-8H,9H2,(H,18,19)
InChIKeyFRWNGGCJAQQOAT-UHFFFAOYSA-N
XLogP4.01
TPSA46.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500397.07
LogP ≤ 54.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'alkyl_halide', 'substructure': 'N/A'}

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Related Compounds

[2-(bromomethyl)phenyl]-(3-bromophenyl)methanone
CID 67346438
3-bromo-N-[2-(hydrazinecarbonyl)phenyl]benzamide
CID 4101681
N-(2-benzoylphenyl)-2-fluoroacetamide
CID 70589823
2-[(3-bromobenzoyl)amino]-N-phenylbenzamide
CID 54790950
N-(2-benzoylphenyl)-3-chloropropanamide
CID 25323415
4-[2-(3-bromobenzoyl)hydrazinyl]-N-(2-chlorophenyl)-4-oxobutanamide
CID 54790870
2-bromo-N-[4-bromo-2-(pyridine-2-carbonyl)phenyl]acetamide;hydrobromide
CID 158180443
N-(2-benzoyl-6-chlorophenyl)-2-bromoacetamide
CID 154233494
2-[[2-(3-bromoanilino)acetyl]amino]benzamide
CID 54840155
(3-bromophenyl)-(4-bromothiophen-3-yl)methanone
CID 10831406
[2-(2-benzoylanilino)-2-oxoethyl] 2-bromobenzoate
CID 4664729
N-(2-benzoyl-4-bromophenyl)-2-methoxyacetamide
CID 166884610

Frequently Asked Questions

What is the IUPAC name of 2-bromo-N-[2-(3-bromobenzoyl)phenyl]acetamide?
The IUPAC name of 2-bromo-N-[2-(3-bromobenzoyl)phenyl]acetamide (CID 150212976) is 2-bromo-N-[2-(3-bromobenzoyl)phenyl]acetamide.
What is the SMILES notation for 2-bromo-N-[2-(3-bromobenzoyl)phenyl]acetamide?
The canonical SMILES for 2-bromo-N-[2-(3-bromobenzoyl)phenyl]acetamide is O=C(CBr)Nc1ccccc1C(=O)c1cccc(Br)c1.
What is the InChIKey of 2-bromo-N-[2-(3-bromobenzoyl)phenyl]acetamide?
The InChIKey is FRWNGGCJAQQOAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11Br2NO2/c16-9-14(19)18-13-7-2-1-6-12(13)15(20)10-4-3-5-11(17)8-10/h1-8H,9H2,(H,18,19).
What are the key properties of 2-bromo-N-[2-(3-bromobenzoyl)phenyl]acetamide?
2-bromo-N-[2-(3-bromobenzoyl)phenyl]acetamide has a molecular weight of 397.07 g/mol, XLogP of 4.01, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bromo-N-[2-(3-bromobenzoyl)phenyl]acetamide is sourced from PubChem (CID 150212976), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).