2-(2-bromo-4-fluoroanilino)-N-(4-bromophenyl)acetamide

C14H11Br2FN2O — CID 28939365

IUPAC2-(2-bromo-4-fluoroanilino)-N-(4-bromophenyl)acetamide
SMILESO=C(CNc1ccc(F)cc1Br)Nc1ccc(Br)cc1
InChIInChI=1S/C14H11Br2FN2O/c15-9-1-4-11(5-2-9)19-14(20)8-18-13-6-3-10(17)7-12(13)16/h1-7,18H,8H2,(H,19,20)
InChIKeyQIXCNCLTTXEMIG-UHFFFAOYSA-N
MW402.06 g/mol
LogP4.40
Rot. Bonds4

About 2-(2-bromo-4-fluoroanilino)-N-(4-bromophenyl)acetamide

2-(2-bromo-4-fluoroanilino)-N-(4-bromophenyl)acetamide (PubChem CID 28939365) has the molecular formula C14H11Br2FN2O and a molecular weight of 402.06 g/mol. Its IUPAC name is 2-(2-bromo-4-fluoroanilino)-N-(4-bromophenyl)acetamide.

Molecular Properties

Compound Name2-(2-bromo-4-fluoroanilino)-N-(4-bromophenyl)acetamide
PubChem CID28939365
Molecular FormulaC14H11Br2FN2O
Molecular Weight402.06 g/mol
Exact Mass399.92
IUPAC Name2-(2-bromo-4-fluoroanilino)-N-(4-bromophenyl)acetamide
SMILESO=C(CNc1ccc(F)cc1Br)Nc1ccc(Br)cc1
InChIInChI=1S/C14H11Br2FN2O/c15-9-1-4-11(5-2-9)19-14(20)8-18-13-6-3-10(17)7-12(13)16/h1-7,18H,8H2,(H,19,20)
InChIKeyQIXCNCLTTXEMIG-UHFFFAOYSA-N
XLogP4.40
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500402.06
LogP ≤ 54.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2-bromo-4-fluoroanilino)-N-(4-chlorophenyl)acetamide
CID 28939364
2-(5-bromo-2-fluoroanilino)-N-(4-bromophenyl)acetamide
CID 43555709
2-(2-bromo-4-fluoroanilino)-N-(2-methylphenyl)acetamide
CID 28939357
2-anilino-N-(2-bromo-4-fluorophenyl)acetamide
CID 60860763
2-(3-bromo-4-fluoroanilino)-N-(4-bromophenyl)acetamide
CID 115650334
N-(3-bromo-4-methylphenyl)-2-(2,4-difluoroanilino)acetamide
CID 109009001
2-(2-bromo-4-methylanilino)-N-(3-fluorophenyl)acetamide
CID 42070161
N-(4-acetamidophenyl)-2-(2,4-difluoroanilino)acetamide
CID 109010043
2-(2,6-dibromo-4-methylanilino)-N-(4-fluorophenyl)acetamide
CID 28991479
2-(5-bromo-4-fluoro-2-methylanilino)-N-(4-fluorophenyl)acetamide
CID 107592105
2-(2-bromo-4-chloroanilino)-N-(3-fluorophenyl)acetamide
CID 81271498
2-(5-fluoro-2-methylanilino)-N-(4-fluorophenyl)acetamide
CID 9099732

Frequently Asked Questions

What is the IUPAC name of 2-(2-bromo-4-fluoroanilino)-N-(4-bromophenyl)acetamide?
The IUPAC name of 2-(2-bromo-4-fluoroanilino)-N-(4-bromophenyl)acetamide (CID 28939365) is 2-(2-bromo-4-fluoroanilino)-N-(4-bromophenyl)acetamide.
What is the SMILES notation for 2-(2-bromo-4-fluoroanilino)-N-(4-bromophenyl)acetamide?
The canonical SMILES for 2-(2-bromo-4-fluoroanilino)-N-(4-bromophenyl)acetamide is O=C(CNc1ccc(F)cc1Br)Nc1ccc(Br)cc1.
What is the InChIKey of 2-(2-bromo-4-fluoroanilino)-N-(4-bromophenyl)acetamide?
The InChIKey is QIXCNCLTTXEMIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11Br2FN2O/c15-9-1-4-11(5-2-9)19-14(20)8-18-13-6-3-10(17)7-12(13)16/h1-7,18H,8H2,(H,19,20).
What are the key properties of 2-(2-bromo-4-fluoroanilino)-N-(4-bromophenyl)acetamide?
2-(2-bromo-4-fluoroanilino)-N-(4-bromophenyl)acetamide has a molecular weight of 402.06 g/mol, XLogP of 4.40, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-bromo-4-fluoroanilino)-N-(4-bromophenyl)acetamide is sourced from PubChem (CID 28939365), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).