4-[(6-fluoro-3-pyridinyl)sulfamoyl]benzamide

C12H10FN3O3S — CID 103775704

IUPAC4-[(6-fluoro-3-pyridinyl)sulfamoyl]benzamide
SMILESNC(=O)c1ccc(S(=O)(=O)Nc2ccc(F)nc2)cc1
InChIInChI=1S/C12H10FN3O3S/c13-11-6-3-9(7-15-11)16-20(18,19)10-4-1-8(2-5-10)12(14)17/h1-7,16H,(H2,14,17)
InChIKeyRKSSGGKUXNTFMQ-UHFFFAOYSA-N
MW295.30 g/mol
LogP1.12
Rot. Bonds4

About 4-[(6-fluoro-3-pyridinyl)sulfamoyl]benzamide

4-[(6-fluoro-3-pyridinyl)sulfamoyl]benzamide (PubChem CID 103775704) has the molecular formula C12H10FN3O3S and a molecular weight of 295.30 g/mol. Its IUPAC name is 4-[(6-fluoro-3-pyridinyl)sulfamoyl]benzamide.

Molecular Properties

Compound Name4-[(6-fluoro-3-pyridinyl)sulfamoyl]benzamide
PubChem CID103775704
Molecular FormulaC12H10FN3O3S
Molecular Weight295.30 g/mol
Exact Mass295.04
IUPAC Name4-[(6-fluoro-3-pyridinyl)sulfamoyl]benzamide
SMILESNC(=O)c1ccc(S(=O)(=O)Nc2ccc(F)nc2)cc1
InChIInChI=1S/C12H10FN3O3S/c13-11-6-3-9(7-15-11)16-20(18,19)10-4-1-8(2-5-10)12(14)17/h1-7,16H,(H2,14,17)
InChIKeyRKSSGGKUXNTFMQ-UHFFFAOYSA-N
XLogP1.12
TPSA102.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.30
LogP ≤ 51.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

4-[(4-fluorophenyl)sulfamoyl]benzamide
CID 2098781
5-[(6-fluoro-3-pyridinyl)sulfamoyl]-2-methylbenzamide
CID 103775627
N-(6-fluoro-3-pyridinyl)-4-methoxybenzenesulfonamide
CID 103775697
4-[(3-amino-4-fluorophenyl)sulfamoyl]benzamide
CID 43604881
4-[(4-methylphenyl)sulfonylamino]benzamide
CID 837332
4-[(4-chlorophenyl)sulfamoyl]benzamide
CID 27187051
3,5-difluoro-N-(6-fluoro-3-pyridinyl)benzenesulfonamide
CID 113259712
4-[(2-chloropyrimidin-5-yl)sulfonylamino]benzamide
CID 43456434
3-acetyl-N-(6-fluoro-3-pyridinyl)benzenesulfonamide
CID 103775761
3,5-dichloro-N-(6-fluoro-3-pyridinyl)benzenesulfonamide
CID 103775753
4-[[4-(difluoromethoxy)phenyl]sulfamoyl]benzamide
CID 46644155
4-[(4-fluorophenyl)sulfamoyl]benzoic acid
CID 2345459

Frequently Asked Questions

What is the IUPAC name of 4-[(6-fluoro-3-pyridinyl)sulfamoyl]benzamide?
The IUPAC name of 4-[(6-fluoro-3-pyridinyl)sulfamoyl]benzamide (CID 103775704) is 4-[(6-fluoro-3-pyridinyl)sulfamoyl]benzamide.
What is the SMILES notation for 4-[(6-fluoro-3-pyridinyl)sulfamoyl]benzamide?
The canonical SMILES for 4-[(6-fluoro-3-pyridinyl)sulfamoyl]benzamide is NC(=O)c1ccc(S(=O)(=O)Nc2ccc(F)nc2)cc1.
What is the InChIKey of 4-[(6-fluoro-3-pyridinyl)sulfamoyl]benzamide?
The InChIKey is RKSSGGKUXNTFMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10FN3O3S/c13-11-6-3-9(7-15-11)16-20(18,19)10-4-1-8(2-5-10)12(14)17/h1-7,16H,(H2,14,17).
What are the key properties of 4-[(6-fluoro-3-pyridinyl)sulfamoyl]benzamide?
4-[(6-fluoro-3-pyridinyl)sulfamoyl]benzamide has a molecular weight of 295.30 g/mol, XLogP of 1.12, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(6-fluoro-3-pyridinyl)sulfamoyl]benzamide is sourced from PubChem (CID 103775704), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).