2-(4-bromo-3,5-dichlorophenyl)acetamide

C8H6BrCl2NO — CID 174389089

IUPAC2-(4-bromo-3,5-dichlorophenyl)acetamide
SMILESNC(=O)Cc1cc(Cl)c(Br)c(Cl)c1
InChIInChI=1S/C8H6BrCl2NO/c9-8-5(10)1-4(2-6(8)11)3-7(12)13/h1-2H,3H2,(H2,12,13)
InChIKeySFUNQAVFCSQOGL-UHFFFAOYSA-N
MW282.95 g/mol
LogP2.78
Rot. Bonds2

About 2-(4-bromo-3,5-dichlorophenyl)acetamide

2-(4-bromo-3,5-dichlorophenyl)acetamide (PubChem CID 174389089) has the molecular formula C8H6BrCl2NO and a molecular weight of 282.95 g/mol. Its IUPAC name is 2-(4-bromo-3,5-dichlorophenyl)acetamide.

Molecular Properties

Compound Name2-(4-bromo-3,5-dichlorophenyl)acetamide
PubChem CID174389089
Molecular FormulaC8H6BrCl2NO
Molecular Weight282.95 g/mol
Exact Mass280.90
IUPAC Name2-(4-bromo-3,5-dichlorophenyl)acetamide
SMILESNC(=O)Cc1cc(Cl)c(Br)c(Cl)c1
InChIInChI=1S/C8H6BrCl2NO/c9-8-5(10)1-4(2-6(8)11)3-7(12)13/h1-2H,3H2,(H2,12,13)
InChIKeySFUNQAVFCSQOGL-UHFFFAOYSA-N
XLogP2.78
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.95
LogP ≤ 52.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'halogenated_ring_2', 'substructure': 'N/A'}

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Related Compounds

2-(3-amino-4-bromo-5-chlorophenyl)acetic acid
CID 131299172
4-bromo-3,5-dichlorobenzohydrazide
CID 169499880
2-(6-chloropyridazin-4-yl)acetamide
CID 162428290
2-(3-bromophenyl)acetamide
CID 11736027
2-(3-bromo-4-hydroxyphenyl)acetamide
CID 57224771
1-(4-bromo-3,5-dichlorophenyl)-2-chloroethanone
CID 171004358
N-[4-(2-amino-2-oxoethyl)phenyl]-4-bromo-3-chlorobenzamide
CID 80973483
2-(5-bromo-2-chloro-3-pyridinyl)acetamide
CID 131075466
2-(3-bromo-5-chloro-4-methylphenyl)acetic acid
CID 171005978
2-[3-(bromomethyl)phenyl]acetamide
CID 151051771
2-[3,5-bis(trifluoromethyl)phenyl]acetamide;dihydrochloride
CID 87486222
methyl 2-(4-bromo-3-chloro-5-nitrophenyl)acetate
CID 171011086

Frequently Asked Questions

What is the IUPAC name of 2-(4-bromo-3,5-dichlorophenyl)acetamide?
The IUPAC name of 2-(4-bromo-3,5-dichlorophenyl)acetamide (CID 174389089) is 2-(4-bromo-3,5-dichlorophenyl)acetamide.
What is the SMILES notation for 2-(4-bromo-3,5-dichlorophenyl)acetamide?
The canonical SMILES for 2-(4-bromo-3,5-dichlorophenyl)acetamide is NC(=O)Cc1cc(Cl)c(Br)c(Cl)c1.
What is the InChIKey of 2-(4-bromo-3,5-dichlorophenyl)acetamide?
The InChIKey is SFUNQAVFCSQOGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H6BrCl2NO/c9-8-5(10)1-4(2-6(8)11)3-7(12)13/h1-2H,3H2,(H2,12,13).
What are the key properties of 2-(4-bromo-3,5-dichlorophenyl)acetamide?
2-(4-bromo-3,5-dichlorophenyl)acetamide has a molecular weight of 282.95 g/mol, XLogP of 2.78, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-bromo-3,5-dichlorophenyl)acetamide is sourced from PubChem (CID 174389089), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).