2-(5-fluoro-2-nitrophenoxy)-N-(3-sulfamoylphenyl)acetamide

C14H12FN3O6S — CID 7846097

IUPAC2-(5-fluoro-2-nitrophenoxy)-N-(3-sulfamoylphenyl)acetamide
SMILESNS(=O)(=O)c1cccc(NC(=O)COc2cc(F)ccc2[N+](=O)[O-])c1
InChIInChI=1S/C14H12FN3O6S/c15-9-4-5-12(18(20)21)13(6-9)24-8-14(19)17-10-2-1-3-11(7-10)25(16,22)23/h1-7H,8H2,(H,17,19)(H2,16,22,23)
InChIKeyBNLMTNPPPGJHFK-UHFFFAOYSA-N
MW369.33 g/mol
LogP1.40
Rot. Bonds6

About 2-(5-fluoro-2-nitrophenoxy)-N-(3-sulfamoylphenyl)acetamide

2-(5-fluoro-2-nitrophenoxy)-N-(3-sulfamoylphenyl)acetamide (PubChem CID 7846097) has the molecular formula C14H12FN3O6S and a molecular weight of 369.33 g/mol. Its IUPAC name is 2-(5-fluoro-2-nitrophenoxy)-N-(3-sulfamoylphenyl)acetamide.

Molecular Properties

Compound Name2-(5-fluoro-2-nitrophenoxy)-N-(3-sulfamoylphenyl)acetamide
PubChem CID7846097
Molecular FormulaC14H12FN3O6S
Molecular Weight369.33 g/mol
Exact Mass369.04
IUPAC Name2-(5-fluoro-2-nitrophenoxy)-N-(3-sulfamoylphenyl)acetamide
SMILESNS(=O)(=O)c1cccc(NC(=O)COc2cc(F)ccc2[N+](=O)[O-])c1
InChIInChI=1S/C14H12FN3O6S/c15-9-4-5-12(18(20)21)13(6-9)24-8-14(19)17-10-2-1-3-11(7-10)25(16,22)23/h1-7H,8H2,(H,17,19)(H2,16,22,23)
InChIKeyBNLMTNPPPGJHFK-UHFFFAOYSA-N
XLogP1.40
TPSA141.63 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.33
LogP ≤ 51.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'nitro_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze 2-(5-fluoro-2-nitrophenoxy)-N-(3-sulfamoylphenyl)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

N-(4-fluorophenyl)-2-(2-nitro-4-sulfamoylphenoxy)acetamide
CID 55529140
N-(3,4-difluorophenyl)-2-(5-fluoro-2-nitrophenoxy)acetamide
CID 2690908
N-(3-iodophenyl)-2-(2-nitro-4-sulfamoylphenoxy)acetamide
CID 55528382
N-(2,6-difluorophenyl)-2-(5-fluoro-2-nitrophenoxy)acetamide
CID 7438488
2-(5-fluoro-2-nitrophenoxy)-N-(4-pyrrolidin-1-ylsulfonylphenyl)acetamide
CID 2565697
2-(2-chlorophenoxy)-N-(3-sulfamoylphenyl)acetamide
CID 7815815
2-(5-fluoro-2-nitrophenoxy)-N-[4-(trifluoromethyl)phenyl]acetamide
CID 7846238
N-(4-tert-butylphenyl)-2-(5-fluoro-2-nitrophenoxy)acetamide
CID 7438477
N-(2,6-diethylphenyl)-2-(5-fluoro-2-nitrophenoxy)acetamide
CID 2690932
2-(5-fluoro-2-nitrophenoxy)-N-(phenylcarbamoyl)acetamide
CID 26814603
[2-oxo-2-(3-sulfamoylanilino)ethyl] 5-chloro-2-nitrobenzoate
CID 3987525
[2-oxo-2-(3-sulfamoylanilino)ethyl] 3-methyl-4-nitrobenzoate
CID 4001820

Frequently Asked Questions

What is the IUPAC name of 2-(5-fluoro-2-nitrophenoxy)-N-(3-sulfamoylphenyl)acetamide?
The IUPAC name of 2-(5-fluoro-2-nitrophenoxy)-N-(3-sulfamoylphenyl)acetamide (CID 7846097) is 2-(5-fluoro-2-nitrophenoxy)-N-(3-sulfamoylphenyl)acetamide.
What is the SMILES notation for 2-(5-fluoro-2-nitrophenoxy)-N-(3-sulfamoylphenyl)acetamide?
The canonical SMILES for 2-(5-fluoro-2-nitrophenoxy)-N-(3-sulfamoylphenyl)acetamide is NS(=O)(=O)c1cccc(NC(=O)COc2cc(F)ccc2[N+](=O)[O-])c1.
What is the InChIKey of 2-(5-fluoro-2-nitrophenoxy)-N-(3-sulfamoylphenyl)acetamide?
The InChIKey is BNLMTNPPPGJHFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12FN3O6S/c15-9-4-5-12(18(20)21)13(6-9)24-8-14(19)17-10-2-1-3-11(7-10)25(16,22)23/h1-7H,8H2,(H,17,19)(H2,16,22,23).
What are the key properties of 2-(5-fluoro-2-nitrophenoxy)-N-(3-sulfamoylphenyl)acetamide?
2-(5-fluoro-2-nitrophenoxy)-N-(3-sulfamoylphenyl)acetamide has a molecular weight of 369.33 g/mol, XLogP of 1.40, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-fluoro-2-nitrophenoxy)-N-(3-sulfamoylphenyl)acetamide is sourced from PubChem (CID 7846097), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).