2-(5-bromo-2-fluoroanilino)-N-(4-bromophenyl)acetamide

C14H11Br2FN2O — CID 43555709

IUPAC2-(5-bromo-2-fluoroanilino)-N-(4-bromophenyl)acetamide
SMILESO=C(CNc1cc(Br)ccc1F)Nc1ccc(Br)cc1
InChIInChI=1S/C14H11Br2FN2O/c15-9-1-4-11(5-2-9)19-14(20)8-18-13-7-10(16)3-6-12(13)17/h1-7,18H,8H2,(H,19,20)
InChIKeyJDBXFTCUFMXVKB-UHFFFAOYSA-N
MW402.06 g/mol
LogP4.40
Rot. Bonds4

About 2-(5-bromo-2-fluoroanilino)-N-(4-bromophenyl)acetamide

2-(5-bromo-2-fluoroanilino)-N-(4-bromophenyl)acetamide (PubChem CID 43555709) has the molecular formula C14H11Br2FN2O and a molecular weight of 402.06 g/mol. Its IUPAC name is 2-(5-bromo-2-fluoroanilino)-N-(4-bromophenyl)acetamide.

Molecular Properties

Compound Name2-(5-bromo-2-fluoroanilino)-N-(4-bromophenyl)acetamide
PubChem CID43555709
Molecular FormulaC14H11Br2FN2O
Molecular Weight402.06 g/mol
Exact Mass399.92
IUPAC Name2-(5-bromo-2-fluoroanilino)-N-(4-bromophenyl)acetamide
SMILESO=C(CNc1cc(Br)ccc1F)Nc1ccc(Br)cc1
InChIInChI=1S/C14H11Br2FN2O/c15-9-1-4-11(5-2-9)19-14(20)8-18-13-7-10(16)3-6-12(13)17/h1-7,18H,8H2,(H,19,20)
InChIKeyJDBXFTCUFMXVKB-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-(3-acetamido-4-fluoroanilino)-N-(4-bromophenyl)acetamide
CID 31766622
2-(5-bromo-2-chloroanilino)-N-(4-chlorophenyl)acetamide
CID 63492462
2-(3-bromo-4-fluoroanilino)-N-(4-bromophenyl)acetamide
CID 115650334
2-(2-bromo-4-fluoroanilino)-N-(4-bromophenyl)acetamide
CID 28939365
2-(5-bromo-2-fluoroanilino)acetic acid
CID 43555633
2-(5-acetamido-2-fluoroanilino)-N-(4-bromo-2-methylphenyl)acetamide
CID 37278653
2-(5-chloro-2-fluoroanilino)-N-(4-methylphenyl)acetamide
CID 43385683
N-(4-bromophenyl)-2-(3-cyano-4-fluoroanilino)acetamide
CID 62317531
2-(4-bromo-2-cyanoanilino)-N-(4-bromophenyl)acetamide
CID 78994184
2-(2-bromo-4-fluoroanilino)-N-(4-chlorophenyl)acetamide
CID 28939364
2-[(5-bromo-2-fluoroanilino)methyl]prop-2-enoic acid
CID 103238968
N-(4-methylphenyl)-2-(2,4,5-trifluoroanilino)acetamide
CID 62816420

Frequently Asked Questions

What is the IUPAC name of 2-(5-bromo-2-fluoroanilino)-N-(4-bromophenyl)acetamide?
The IUPAC name of 2-(5-bromo-2-fluoroanilino)-N-(4-bromophenyl)acetamide (CID 43555709) is 2-(5-bromo-2-fluoroanilino)-N-(4-bromophenyl)acetamide.
What is the SMILES notation for 2-(5-bromo-2-fluoroanilino)-N-(4-bromophenyl)acetamide?
The canonical SMILES for 2-(5-bromo-2-fluoroanilino)-N-(4-bromophenyl)acetamide is O=C(CNc1cc(Br)ccc1F)Nc1ccc(Br)cc1.
What is the InChIKey of 2-(5-bromo-2-fluoroanilino)-N-(4-bromophenyl)acetamide?
The InChIKey is JDBXFTCUFMXVKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11Br2FN2O/c15-9-1-4-11(5-2-9)19-14(20)8-18-13-7-10(16)3-6-12(13)17/h1-7,18H,8H2,(H,19,20).
What are the key properties of 2-(5-bromo-2-fluoroanilino)-N-(4-bromophenyl)acetamide?
2-(5-bromo-2-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-(5-bromo-2-fluoroanilino)-N-(4-bromophenyl)acetamide is sourced from PubChem (CID 43555709), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).