2-bromo-N-(2-bromo-5-chloro-3-pyridinyl)acetamide

C7H5Br2ClN2O — CID 130535402

IUPAC2-bromo-N-(2-bromo-5-chloro-3-pyridinyl)acetamide
SMILESO=C(CBr)Nc1cc(Cl)cnc1Br
InChIInChI=1S/C7H5Br2ClN2O/c8-2-6(13)12-5-1-4(10)3-11-7(5)9/h1,3H,2H2,(H,12,13)
InChIKeyXEFJWMPAEQISMO-UHFFFAOYSA-N
MW328.39 g/mol
LogP2.83
Rot. Bonds2

About 2-bromo-N-(2-bromo-5-chloro-3-pyridinyl)acetamide

2-bromo-N-(2-bromo-5-chloro-3-pyridinyl)acetamide (PubChem CID 130535402) has the molecular formula C7H5Br2ClN2O and a molecular weight of 328.39 g/mol. Its IUPAC name is 2-bromo-N-(2-bromo-5-chloro-3-pyridinyl)acetamide.

Molecular Properties

Compound Name2-bromo-N-(2-bromo-5-chloro-3-pyridinyl)acetamide
PubChem CID130535402
Molecular FormulaC7H5Br2ClN2O
Molecular Weight328.39 g/mol
Exact Mass325.85
IUPAC Name2-bromo-N-(2-bromo-5-chloro-3-pyridinyl)acetamide
SMILESO=C(CBr)Nc1cc(Cl)cnc1Br
InChIInChI=1S/C7H5Br2ClN2O/c8-2-6(13)12-5-1-4(10)3-11-7(5)9/h1,3H,2H2,(H,12,13)
InChIKeyXEFJWMPAEQISMO-UHFFFAOYSA-N
XLogP2.83
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.39
LogP ≤ 52.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'alkyl_halide', 'substructure': 'N/A'}

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Related Compounds

N-(2-bromo-5-chloro-3-pyridinyl)acetamide
CID 130535452
3-amino-N-(2-bromo-5-chloro-3-pyridinyl)hexanamide
CID 112749983
N-(2-bromo-5-chloro-3-pyridinyl)-2-methylpyridine-4-carboxamide
CID 112750056
2-bromo-5-chloro-N-(2,2-dimethylpropyl)pyridin-3-amine
CID 130535397
N-(2-bromo-5-chloro-3-pyridinyl)-2,2-dimethylcyclopentane-1-carboxamide
CID 112750068
N-(2-bromo-5-methyl-3-pyridinyl)acetamide
CID 13467716
2-bromo-N-(4-chloro-2-iodophenyl)acetamide
CID 107624932
2-bromo-N-(5-bromo-4-methyl-2-pyridinyl)acetamide
CID 79734217
methyl 2-[(2-bromoacetyl)amino]-4,6-dichlorobenzoate
CID 22364769
N-(5-chloro-2-methyl-3-pyridinyl)acetamide;ethane
CID 142359065
N-(2-bromo-5-chloro-3-pyridinyl)prop-2-ene-1-sulfonamide
CID 130535524
methyl 3-[(2-bromoacetyl)amino]-5-chloro-2-hydroxybenzoate
CID 134990934

Frequently Asked Questions

What is the IUPAC name of 2-bromo-N-(2-bromo-5-chloro-3-pyridinyl)acetamide?
The IUPAC name of 2-bromo-N-(2-bromo-5-chloro-3-pyridinyl)acetamide (CID 130535402) is 2-bromo-N-(2-bromo-5-chloro-3-pyridinyl)acetamide.
What is the SMILES notation for 2-bromo-N-(2-bromo-5-chloro-3-pyridinyl)acetamide?
The canonical SMILES for 2-bromo-N-(2-bromo-5-chloro-3-pyridinyl)acetamide is O=C(CBr)Nc1cc(Cl)cnc1Br.
What is the InChIKey of 2-bromo-N-(2-bromo-5-chloro-3-pyridinyl)acetamide?
The InChIKey is XEFJWMPAEQISMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H5Br2ClN2O/c8-2-6(13)12-5-1-4(10)3-11-7(5)9/h1,3H,2H2,(H,12,13).
What are the key properties of 2-bromo-N-(2-bromo-5-chloro-3-pyridinyl)acetamide?
2-bromo-N-(2-bromo-5-chloro-3-pyridinyl)acetamide has a molecular weight of 328.39 g/mol, XLogP of 2.83, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-bromo-N-(2-bromo-5-chloro-3-pyridinyl)acetamide is sourced from PubChem (CID 130535402), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).