N-(2-chloropropyl)-3-fluoropyridine-2-sulfonamide

C8H10ClFN2O2S — CID 103308189

IUPACN-(2-chloropropyl)-3-fluoropyridine-2-sulfonamide
SMILESCC(Cl)CNS(=O)(=O)c1ncccc1F
InChIInChI=1S/C8H10ClFN2O2S/c1-6(9)5-12-15(13,14)8-7(10)3-2-4-11-8/h2-4,6,12H,5H2,1H3
InChIKeyHAKQAJUOLOUHKL-UHFFFAOYSA-N
MW252.70 g/mol
LogP1.13
Rot. Bonds4

About N-(2-chloropropyl)-3-fluoropyridine-2-sulfonamide

N-(2-chloropropyl)-3-fluoropyridine-2-sulfonamide (PubChem CID 103308189) has the molecular formula C8H10ClFN2O2S and a molecular weight of 252.70 g/mol. Its IUPAC name is N-(2-chloropropyl)-3-fluoropyridine-2-sulfonamide.

Molecular Properties

Compound NameN-(2-chloropropyl)-3-fluoropyridine-2-sulfonamide
PubChem CID103308189
Molecular FormulaC8H10ClFN2O2S
Molecular Weight252.70 g/mol
Exact Mass252.01
IUPAC NameN-(2-chloropropyl)-3-fluoropyridine-2-sulfonamide
SMILESCC(Cl)CNS(=O)(=O)c1ncccc1F
InChIInChI=1S/C8H10ClFN2O2S/c1-6(9)5-12-15(13,14)8-7(10)3-2-4-11-8/h2-4,6,12H,5H2,1H3
InChIKeyHAKQAJUOLOUHKL-UHFFFAOYSA-N
XLogP1.13
TPSA59.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.70
LogP ≤ 51.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze N-(2-chloropropyl)-3-fluoropyridine-2-sulfonamide 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

3-fluoro-N-(3-hydroxy-2-methylpropyl)pyridine-2-sulfonamide
CID 103300164
N-(2-bromobutyl)-3-fluoropyridine-2-sulfonamide
CID 103308428
2-[[(3-fluoro-2-pyridinyl)sulfonylamino]methyl]-3-methylbutanoic acid
CID 103298831
N-(2-amino-4,4-dimethylpentyl)-3-fluoropyridine-2-sulfonamide
CID 107158974
N-(2-amino-2-methylpropyl)-3-fluoropyridine-2-sulfonamide
CID 103302638
N-but-3-en-2-yl-3-fluoropyridine-2-sulfonamide
CID 103300448
N-[4-(1-aminoethyl)phenyl]-3-fluoropyridine-2-sulfonamide
CID 103298978
N-benzyl-3-fluoropyridine-2-sulfonamide
CID 103299072
N-(2-ethoxyethyl)-3-fluoropyridine-2-sulfonamide
CID 103299268
3-fluoro-N-[(4-methylphenyl)methyl]pyridine-2-sulfonamide
CID 103299052
N-[2-(dimethylsulfamoyl)ethyl]-3-fluoropyridine-2-sulfonamide
CID 114175143
N-[2-(ethylsulfamoyl)ethyl]-3-fluoropyridine-2-sulfonamide
CID 114175137

Frequently Asked Questions

What is the IUPAC name of N-(2-chloropropyl)-3-fluoropyridine-2-sulfonamide?
The IUPAC name of N-(2-chloropropyl)-3-fluoropyridine-2-sulfonamide (CID 103308189) is N-(2-chloropropyl)-3-fluoropyridine-2-sulfonamide.
What is the SMILES notation for N-(2-chloropropyl)-3-fluoropyridine-2-sulfonamide?
The canonical SMILES for N-(2-chloropropyl)-3-fluoropyridine-2-sulfonamide is CC(Cl)CNS(=O)(=O)c1ncccc1F.
What is the InChIKey of N-(2-chloropropyl)-3-fluoropyridine-2-sulfonamide?
The InChIKey is HAKQAJUOLOUHKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10ClFN2O2S/c1-6(9)5-12-15(13,14)8-7(10)3-2-4-11-8/h2-4,6,12H,5H2,1H3.
What are the key properties of N-(2-chloropropyl)-3-fluoropyridine-2-sulfonamide?
N-(2-chloropropyl)-3-fluoropyridine-2-sulfonamide has a molecular weight of 252.70 g/mol, XLogP of 1.13, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chloropropyl)-3-fluoropyridine-2-sulfonamide is sourced from PubChem (CID 103308189), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).