2-(2-bromo-4-chloroanilino)-N-(3-bromophenyl)acetamide

C14H11Br2ClN2O — CID 81271166

IUPAC2-(2-bromo-4-chloroanilino)-N-(3-bromophenyl)acetamide
SMILESO=C(CNc1ccc(Cl)cc1Br)Nc1cccc(Br)c1
InChIInChI=1S/C14H11Br2ClN2O/c15-9-2-1-3-11(6-9)19-14(20)8-18-13-5-4-10(17)7-12(13)16/h1-7,18H,8H2,(H,19,20)
InChIKeyTYSAMMPZOKUSKU-UHFFFAOYSA-N
MW418.52 g/mol
LogP4.92
Rot. Bonds4

About 2-(2-bromo-4-chloroanilino)-N-(3-bromophenyl)acetamide

2-(2-bromo-4-chloroanilino)-N-(3-bromophenyl)acetamide (PubChem CID 81271166) has the molecular formula C14H11Br2ClN2O and a molecular weight of 418.52 g/mol. Its IUPAC name is 2-(2-bromo-4-chloroanilino)-N-(3-bromophenyl)acetamide.

Molecular Properties

Compound Name2-(2-bromo-4-chloroanilino)-N-(3-bromophenyl)acetamide
PubChem CID81271166
Molecular FormulaC14H11Br2ClN2O
Molecular Weight418.52 g/mol
Exact Mass415.89
IUPAC Name2-(2-bromo-4-chloroanilino)-N-(3-bromophenyl)acetamide
SMILESO=C(CNc1ccc(Cl)cc1Br)Nc1cccc(Br)c1
InChIInChI=1S/C14H11Br2ClN2O/c15-9-2-1-3-11(6-9)19-14(20)8-18-13-5-4-10(17)7-12(13)16/h1-7,18H,8H2,(H,19,20)
InChIKeyTYSAMMPZOKUSKU-UHFFFAOYSA-N
XLogP4.92
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500418.52
LogP ≤ 54.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(2-bromo-5-chloroanilino)-N-(3-bromophenyl)acetamide
CID 81281124
2-(2-bromo-4-chloroanilino)-N-(3-fluorophenyl)acetamide
CID 81271498
N-(3-bromophenyl)-2-(2,4,5-trichloroanilino)acetamide
CID 28515380
2-(3-bromoanilino)-N-(4-chlorophenyl)acetamide
CID 9080372
N-(3-bromophenyl)-2-(2,4,6-tribromoanilino)acetamide
CID 43126391
2-(4-bromoanilino)-N-(3-bromophenyl)acetamide
CID 7492464
2-(2,4-dibromoanilino)-N-(2,6-dichlorophenyl)acetamide
CID 60687966
N-(3-bromophenyl)-2-(2,5-difluoro-4-methylanilino)acetamide
CID 103585627
2-(2-bromo-4-chlorophenoxy)-N-(3-bromophenyl)acetamide
CID 19202088
2-(3-bromo-5-methylanilino)-N-(3-chlorophenyl)acetamide
CID 107583061
2-(2-bromo-4-fluoroanilino)-N-(4-chlorophenyl)acetamide
CID 28939364
N-(2-bromo-4-chlorophenyl)-2-(3-bromophenyl)acetamide
CID 81271927

Frequently Asked Questions

What is the IUPAC name of 2-(2-bromo-4-chloroanilino)-N-(3-bromophenyl)acetamide?
The IUPAC name of 2-(2-bromo-4-chloroanilino)-N-(3-bromophenyl)acetamide (CID 81271166) is 2-(2-bromo-4-chloroanilino)-N-(3-bromophenyl)acetamide.
What is the SMILES notation for 2-(2-bromo-4-chloroanilino)-N-(3-bromophenyl)acetamide?
The canonical SMILES for 2-(2-bromo-4-chloroanilino)-N-(3-bromophenyl)acetamide is O=C(CNc1ccc(Cl)cc1Br)Nc1cccc(Br)c1.
What is the InChIKey of 2-(2-bromo-4-chloroanilino)-N-(3-bromophenyl)acetamide?
The InChIKey is TYSAMMPZOKUSKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11Br2ClN2O/c15-9-2-1-3-11(6-9)19-14(20)8-18-13-5-4-10(17)7-12(13)16/h1-7,18H,8H2,(H,19,20).
What are the key properties of 2-(2-bromo-4-chloroanilino)-N-(3-bromophenyl)acetamide?
2-(2-bromo-4-chloroanilino)-N-(3-bromophenyl)acetamide has a molecular weight of 418.52 g/mol, XLogP of 4.92, 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-chloroanilino)-N-(3-bromophenyl)acetamide is sourced from PubChem (CID 81271166), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).