2-(N-acetyl-2,6-difluoroanilino)-N-(2-bromophenyl)acetamide

C16H13BrF2N2O2 — CID 113181523

IUPAC2-(N-acetyl-2,6-difluoroanilino)-N-(2-bromophenyl)acetamide
SMILESCC(=O)N(CC(=O)Nc1ccccc1Br)c1c(F)cccc1F
InChIInChI=1S/C16H13BrF2N2O2/c1-10(22)21(16-12(18)6-4-7-13(16)19)9-15(23)20-14-8-3-2-5-11(14)17/h2-8H,9H2,1H3,(H,20,23)
InChIKeyFVJUSMWTZQBERU-UHFFFAOYSA-N
MW383.19 g/mol
LogP3.72
Rot. Bonds4

About 2-(N-acetyl-2,6-difluoroanilino)-N-(2-bromophenyl)acetamide

2-(N-acetyl-2,6-difluoroanilino)-N-(2-bromophenyl)acetamide (PubChem CID 113181523) has the molecular formula C16H13BrF2N2O2 and a molecular weight of 383.19 g/mol. Its IUPAC name is 2-(N-acetyl-2,6-difluoroanilino)-N-(2-bromophenyl)acetamide.

Molecular Properties

Compound Name2-(N-acetyl-2,6-difluoroanilino)-N-(2-bromophenyl)acetamide
PubChem CID113181523
Molecular FormulaC16H13BrF2N2O2
Molecular Weight383.19 g/mol
Exact Mass382.01
IUPAC Name2-(N-acetyl-2,6-difluoroanilino)-N-(2-bromophenyl)acetamide
SMILESCC(=O)N(CC(=O)Nc1ccccc1Br)c1c(F)cccc1F
InChIInChI=1S/C16H13BrF2N2O2/c1-10(22)21(16-12(18)6-4-7-13(16)19)9-15(23)20-14-8-3-2-5-11(14)17/h2-8H,9H2,1H3,(H,20,23)
InChIKeyFVJUSMWTZQBERU-UHFFFAOYSA-N
XLogP3.72
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500383.19
LogP ≤ 53.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(N-acetyl-2,6-difluoroanilino)-N-(2-methoxyphenyl)acetamide
CID 113181493
2-(N-acetyl-2,6-difluoroanilino)-N-(2-cyanophenyl)acetamide
CID 113181547
2-(N-acetyl-2,6-difluoroanilino)-N-(4-fluorophenyl)acetamide
CID 113181479
2-(N-acetyl-3,5-dimethylanilino)-N-(2-bromophenyl)acetamide
CID 113168590
2-(N-acetyl-2,6-difluoroanilino)-N-(3-methylphenyl)acetamide
CID 113181456
2-(N-acetyl-2-ethyl-6-methylanilino)-N-(2-fluorophenyl)acetamide
CID 113169505
3-[acetyl-[(2-fluorophenyl)methyl]amino]-N-(2-bromophenyl)propanamide
CID 113119208
2-(N-acetyl-2,6-difluoroanilino)-N-[4-(dimethylamino)phenyl]acetamide
CID 113181515
2-(N-acetyl-2,6-dimethylanilino)-N-(2-methylphenyl)acetamide
CID 113168713
3-(N-acetyl-2,6-difluoroanilino)-N-(2-propan-2-ylphenyl)propanamide
CID 113135416
N-(2-bromophenyl)-2-(dimethylamino)acetamide;hydrochloride
CID 2959503
2-(N-acetyl-2-bromoanilino)-N-(2-methylphenyl)acetamide
CID 113177819

Frequently Asked Questions

What is the IUPAC name of 2-(N-acetyl-2,6-difluoroanilino)-N-(2-bromophenyl)acetamide?
The IUPAC name of 2-(N-acetyl-2,6-difluoroanilino)-N-(2-bromophenyl)acetamide (CID 113181523) is 2-(N-acetyl-2,6-difluoroanilino)-N-(2-bromophenyl)acetamide.
What is the SMILES notation for 2-(N-acetyl-2,6-difluoroanilino)-N-(2-bromophenyl)acetamide?
The canonical SMILES for 2-(N-acetyl-2,6-difluoroanilino)-N-(2-bromophenyl)acetamide is CC(=O)N(CC(=O)Nc1ccccc1Br)c1c(F)cccc1F.
What is the InChIKey of 2-(N-acetyl-2,6-difluoroanilino)-N-(2-bromophenyl)acetamide?
The InChIKey is FVJUSMWTZQBERU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13BrF2N2O2/c1-10(22)21(16-12(18)6-4-7-13(16)19)9-15(23)20-14-8-3-2-5-11(14)17/h2-8H,9H2,1H3,(H,20,23).
What are the key properties of 2-(N-acetyl-2,6-difluoroanilino)-N-(2-bromophenyl)acetamide?
2-(N-acetyl-2,6-difluoroanilino)-N-(2-bromophenyl)acetamide has a molecular weight of 383.19 g/mol, XLogP of 3.72, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(N-acetyl-2,6-difluoroanilino)-N-(2-bromophenyl)acetamide is sourced from PubChem (CID 113181523), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).