2-[(2-bromo-3-pyridinyl)oxy]-N-(2-fluorophenyl)acetamide

C13H10BrFN2O2 — CID 65102015

IUPAC2-[(2-bromo-3-pyridinyl)oxy]-N-(2-fluorophenyl)acetamide
SMILESO=C(COc1cccnc1Br)Nc1ccccc1F
InChIInChI=1S/C13H10BrFN2O2/c14-13-11(6-3-7-16-13)19-8-12(18)17-10-5-2-1-4-9(10)15/h1-7H,8H2,(H,17,18)
InChIKeyGSSXFOSDTNDADX-UHFFFAOYSA-N
MW325.14 g/mol
LogP3.00
Rot. Bonds4

About 2-[(2-bromo-3-pyridinyl)oxy]-N-(2-fluorophenyl)acetamide

2-[(2-bromo-3-pyridinyl)oxy]-N-(2-fluorophenyl)acetamide (PubChem CID 65102015) has the molecular formula C13H10BrFN2O2 and a molecular weight of 325.14 g/mol. Its IUPAC name is 2-[(2-bromo-3-pyridinyl)oxy]-N-(2-fluorophenyl)acetamide.

Molecular Properties

Compound Name2-[(2-bromo-3-pyridinyl)oxy]-N-(2-fluorophenyl)acetamide
PubChem CID65102015
Molecular FormulaC13H10BrFN2O2
Molecular Weight325.14 g/mol
Exact Mass323.99
IUPAC Name2-[(2-bromo-3-pyridinyl)oxy]-N-(2-fluorophenyl)acetamide
SMILESO=C(COc1cccnc1Br)Nc1ccccc1F
InChIInChI=1S/C13H10BrFN2O2/c14-13-11(6-3-7-16-13)19-8-12(18)17-10-5-2-1-4-9(10)15/h1-7H,8H2,(H,17,18)
InChIKeyGSSXFOSDTNDADX-UHFFFAOYSA-N
XLogP3.00
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.14
LogP ≤ 53.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 2-[(2-bromo-3-pyridinyl)oxy]-N-(2-fluorophenyl)acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(2,3-dimethylphenoxy)-N-(2-fluorophenyl)acetamide
CID 720662
2-(2-bromo-4-chlorophenoxy)-N-(2-fluorophenyl)acetamide
CID 2627508
N-(4-bromophenyl)-2-[2-(2-fluoroanilino)-2-oxoethoxy]benzamide
CID 26913940
2-(4-bromo-2,3,5-trimethylphenoxy)-N-(2-fluorophenyl)acetamide
CID 4650894
3-bromo-4-[2-(2-fluoroanilino)-2-oxoethoxy]benzoic acid
CID 45447437
2-(2-bromo-4-phenylphenoxy)-N-(2-fluorophenyl)acetamide
CID 4960694
2-[2-(2-fluoroanilino)-2-oxoethoxy]-N-(8-methylquinolin-5-yl)benzamide
CID 38277954
[2-(2-fluoroanilino)-2-oxoethyl] pyridine-2-carboxylate
CID 1088633
2-(4-bromo-2-fluorophenoxy)-N-(2-chloro-3-pyridinyl)acetamide
CID 2522815
2-(4-bromo-2-propan-2-ylphenoxy)-N-(2-fluorophenyl)acetamide
CID 17188911
N-(6-chloroquinolin-8-yl)-2-[2-(2-fluoroanilino)-2-oxoethoxy]benzamide
CID 43052391
N-(2,6-difluorophenyl)-2-(2-fluorophenoxy)acetamide
CID 892688

Frequently Asked Questions

What is the IUPAC name of 2-[(2-bromo-3-pyridinyl)oxy]-N-(2-fluorophenyl)acetamide?
The IUPAC name of 2-[(2-bromo-3-pyridinyl)oxy]-N-(2-fluorophenyl)acetamide (CID 65102015) is 2-[(2-bromo-3-pyridinyl)oxy]-N-(2-fluorophenyl)acetamide.
What is the SMILES notation for 2-[(2-bromo-3-pyridinyl)oxy]-N-(2-fluorophenyl)acetamide?
The canonical SMILES for 2-[(2-bromo-3-pyridinyl)oxy]-N-(2-fluorophenyl)acetamide is O=C(COc1cccnc1Br)Nc1ccccc1F.
What is the InChIKey of 2-[(2-bromo-3-pyridinyl)oxy]-N-(2-fluorophenyl)acetamide?
The InChIKey is GSSXFOSDTNDADX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10BrFN2O2/c14-13-11(6-3-7-16-13)19-8-12(18)17-10-5-2-1-4-9(10)15/h1-7H,8H2,(H,17,18).
What are the key properties of 2-[(2-bromo-3-pyridinyl)oxy]-N-(2-fluorophenyl)acetamide?
2-[(2-bromo-3-pyridinyl)oxy]-N-(2-fluorophenyl)acetamide has a molecular weight of 325.14 g/mol, XLogP of 3.00, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-bromo-3-pyridinyl)oxy]-N-(2-fluorophenyl)acetamide is sourced from PubChem (CID 65102015), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).