N-(2-benzoyl-4-bromophenyl)-2-methoxyacetamide

C16H14BrNO3 — CID 166884610

IUPACN-(2-benzoyl-4-bromophenyl)-2-methoxyacetamide
SMILESCOCC(=O)Nc1ccc(Br)cc1C(=O)c1ccccc1
InChIInChI=1S/C16H14BrNO3/c1-21-10-15(19)18-14-8-7-12(17)9-13(14)16(20)11-5-3-2-4-6-11/h2-9H,10H2,1H3,(H,18,19)
InChIKeyQTUMTDBXVHFGJX-UHFFFAOYSA-N
MW348.20 g/mol
LogP3.27
Rot. Bonds5

About N-(2-benzoyl-4-bromophenyl)-2-methoxyacetamide

N-(2-benzoyl-4-bromophenyl)-2-methoxyacetamide (PubChem CID 166884610) has the molecular formula C16H14BrNO3 and a molecular weight of 348.20 g/mol. Its IUPAC name is N-(2-benzoyl-4-bromophenyl)-2-methoxyacetamide.

Molecular Properties

Compound NameN-(2-benzoyl-4-bromophenyl)-2-methoxyacetamide
PubChem CID166884610
Molecular FormulaC16H14BrNO3
Molecular Weight348.20 g/mol
Exact Mass347.02
IUPAC NameN-(2-benzoyl-4-bromophenyl)-2-methoxyacetamide
SMILESCOCC(=O)Nc1ccc(Br)cc1C(=O)c1ccccc1
InChIInChI=1S/C16H14BrNO3/c1-21-10-15(19)18-14-8-7-12(17)9-13(14)16(20)11-5-3-2-4-6-11/h2-9H,10H2,1H3,(H,18,19)
InChIKeyQTUMTDBXVHFGJX-UHFFFAOYSA-N
XLogP3.27
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.20
LogP ≤ 53.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(2-benzoyl-4-bromophenyl)thiourea
CID 169360025
N-(2-benzoyl-4-bromophenyl)-2-(2,4-dimethylphenyl)acetamide
CID 41099780
N-(2-benzoyl-4-bromophenyl)-3,4-dimethoxybenzamide
CID 21204048
2-(2-benzoyl-4-bromoanilino)-N-(4-methoxyphenyl)acetamide
CID 4500110
N-[2-(2-benzoyl-4-bromoanilino)-2-oxoethyl]-4-chlorobenzamide
CID 1104902
N-(2-benzoyl-4-bromophenyl)-2,3-dimethoxybenzamide
CID 40996274
N-(2-benzoyl-4-bromophenyl)-5-chloro-2-methoxybenzamide
CID 4546153
N-(5-bromo-2-methoxyphenyl)-2-methoxyacetamide
CID 61072543
[2-(2-benzoyl-4-chloroanilino)-2-oxoethyl] 2-[(4-bromobenzoyl)amino]propanoate
CID 4260264
N-(2-benzoyl-4-bromophenyl)naphthalene-2-carboxamide
CID 23941186
[2-(2-benzoyl-4-chloroanilino)-2-oxoethyl] 2-methylpropanoate
CID 7782592
4-[[2-(2-benzoyl-4-bromoanilino)acetyl]amino]benzoic acid
CID 4500113

Frequently Asked Questions

What is the IUPAC name of N-(2-benzoyl-4-bromophenyl)-2-methoxyacetamide?
The IUPAC name of N-(2-benzoyl-4-bromophenyl)-2-methoxyacetamide (CID 166884610) is N-(2-benzoyl-4-bromophenyl)-2-methoxyacetamide.
What is the SMILES notation for N-(2-benzoyl-4-bromophenyl)-2-methoxyacetamide?
The canonical SMILES for N-(2-benzoyl-4-bromophenyl)-2-methoxyacetamide is COCC(=O)Nc1ccc(Br)cc1C(=O)c1ccccc1.
What is the InChIKey of N-(2-benzoyl-4-bromophenyl)-2-methoxyacetamide?
The InChIKey is QTUMTDBXVHFGJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14BrNO3/c1-21-10-15(19)18-14-8-7-12(17)9-13(14)16(20)11-5-3-2-4-6-11/h2-9H,10H2,1H3,(H,18,19).
What are the key properties of N-(2-benzoyl-4-bromophenyl)-2-methoxyacetamide?
N-(2-benzoyl-4-bromophenyl)-2-methoxyacetamide has a molecular weight of 348.20 g/mol, XLogP of 3.27, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-benzoyl-4-bromophenyl)-2-methoxyacetamide is sourced from PubChem (CID 166884610), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).