2-(2-bromo-6-fluoroanilino)-N-(4-methylphenyl)acetamide

C15H14BrFN2O — CID 103741858

IUPAC2-(2-bromo-6-fluoroanilino)-N-(4-methylphenyl)acetamide
SMILESCc1ccc(NC(=O)CNc2c(F)cccc2Br)cc1
InChIInChI=1S/C15H14BrFN2O/c1-10-5-7-11(8-6-10)19-14(20)9-18-15-12(16)3-2-4-13(15)17/h2-8,18H,9H2,1H3,(H,19,20)
InChIKeyHVKCTUKIXIJJKH-UHFFFAOYSA-N
MW337.19 g/mol
LogP3.95
Rot. Bonds4

About 2-(2-bromo-6-fluoroanilino)-N-(4-methylphenyl)acetamide

2-(2-bromo-6-fluoroanilino)-N-(4-methylphenyl)acetamide (PubChem CID 103741858) has the molecular formula C15H14BrFN2O and a molecular weight of 337.19 g/mol. Its IUPAC name is 2-(2-bromo-6-fluoroanilino)-N-(4-methylphenyl)acetamide.

Molecular Properties

Compound Name2-(2-bromo-6-fluoroanilino)-N-(4-methylphenyl)acetamide
PubChem CID103741858
Molecular FormulaC15H14BrFN2O
Molecular Weight337.19 g/mol
Exact Mass336.03
IUPAC Name2-(2-bromo-6-fluoroanilino)-N-(4-methylphenyl)acetamide
SMILESCc1ccc(NC(=O)CNc2c(F)cccc2Br)cc1
InChIInChI=1S/C15H14BrFN2O/c1-10-5-7-11(8-6-10)19-14(20)9-18-15-12(16)3-2-4-13(15)17/h2-8,18H,9H2,1H3,(H,19,20)
InChIKeyHVKCTUKIXIJJKH-UHFFFAOYSA-N
XLogP3.95
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.19
LogP ≤ 53.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2-bromo-6-fluoroanilino)-N-(3-chlorophenyl)acetamide
CID 107599222
2-(2,6-dibromoanilino)-N-(4-methoxyphenyl)acetamide
CID 107598910
2-(2,6-dibromo-4-methylanilino)-N-(4-fluorophenyl)acetamide
CID 28991479
[2-(2,6-difluoroanilino)-2-oxoethyl]-methyl-[2-(4-methylanilino)-2-oxoethyl]azanium
CID 8729153
2-(2-bromo-6-fluoroanilino)-N-(3-methylbutyl)acetamide
CID 113252866
2-(2,6-difluoroanilino)-N-[(4-methylphenyl)methyl]acetamide
CID 108997244
N-(4-methylphenyl)-2-(2,4,5-trifluoroanilino)acetamide
CID 62816420
2-(2,6-dibromo-4-methylanilino)-N-phenylacetamide
CID 28887968
N-(2-bromo-6-fluorophenyl)acetamide
CID 59145529
N-(2,6-diethylphenyl)-2-(2,6-difluoroanilino)acetamide
CID 109008077
N-(3,5-dichlorophenyl)-2-(2,6-difluoroanilino)acetamide
CID 109011204
N'-(2,6-difluorophenyl)-N-(3,5-dimethylphenyl)propanediamide
CID 108953753

Frequently Asked Questions

What is the IUPAC name of 2-(2-bromo-6-fluoroanilino)-N-(4-methylphenyl)acetamide?
The IUPAC name of 2-(2-bromo-6-fluoroanilino)-N-(4-methylphenyl)acetamide (CID 103741858) is 2-(2-bromo-6-fluoroanilino)-N-(4-methylphenyl)acetamide.
What is the SMILES notation for 2-(2-bromo-6-fluoroanilino)-N-(4-methylphenyl)acetamide?
The canonical SMILES for 2-(2-bromo-6-fluoroanilino)-N-(4-methylphenyl)acetamide is Cc1ccc(NC(=O)CNc2c(F)cccc2Br)cc1.
What is the InChIKey of 2-(2-bromo-6-fluoroanilino)-N-(4-methylphenyl)acetamide?
The InChIKey is HVKCTUKIXIJJKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14BrFN2O/c1-10-5-7-11(8-6-10)19-14(20)9-18-15-12(16)3-2-4-13(15)17/h2-8,18H,9H2,1H3,(H,19,20).
What are the key properties of 2-(2-bromo-6-fluoroanilino)-N-(4-methylphenyl)acetamide?
2-(2-bromo-6-fluoroanilino)-N-(4-methylphenyl)acetamide has a molecular weight of 337.19 g/mol, XLogP of 3.95, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-bromo-6-fluoroanilino)-N-(4-methylphenyl)acetamide is sourced from PubChem (CID 103741858), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).