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

C9H13FN2O3S — CID 103299268

IUPACN-(2-ethoxyethyl)-3-fluoropyridine-2-sulfonamide
SMILESCCOCCNS(=O)(=O)c1ncccc1F
InChIInChI=1S/C9H13FN2O3S/c1-2-15-7-6-12-16(13,14)9-8(10)4-3-5-11-9/h3-5,12H,2,6-7H2,1H3
InChIKeyDOLNLZUDVKJQAO-UHFFFAOYSA-N
MW248.28 g/mol
LogP0.54
Rot. Bonds6

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

N-(2-ethoxyethyl)-3-fluoropyridine-2-sulfonamide (PubChem CID 103299268) has the molecular formula C9H13FN2O3S and a molecular weight of 248.28 g/mol. Its IUPAC name is N-(2-ethoxyethyl)-3-fluoropyridine-2-sulfonamide.

Molecular Properties

Compound NameN-(2-ethoxyethyl)-3-fluoropyridine-2-sulfonamide
PubChem CID103299268
Molecular FormulaC9H13FN2O3S
Molecular Weight248.28 g/mol
Exact Mass248.06
IUPAC NameN-(2-ethoxyethyl)-3-fluoropyridine-2-sulfonamide
SMILESCCOCCNS(=O)(=O)c1ncccc1F
InChIInChI=1S/C9H13FN2O3S/c1-2-15-7-6-12-16(13,14)9-8(10)4-3-5-11-9/h3-5,12H,2,6-7H2,1H3
InChIKeyDOLNLZUDVKJQAO-UHFFFAOYSA-N
XLogP0.54
TPSA68.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.28
LogP ≤ 50.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-[2-[2-(dimethylamino)ethoxy]ethyl]-3-fluoropyridine-2-sulfonamide
CID 114127258
N-[2-(ethylsulfamoyl)ethyl]-3-fluoropyridine-2-sulfonamide
CID 114175137
ethyl 2-[(3-fluoro-2-pyridinyl)sulfonylamino]acetate
CID 103299284
2-(aminomethyl)-N-(2-ethoxyethyl)pyridine-3-sulfonamide
CID 106593983
N-[2-(dimethylsulfamoyl)ethyl]-3-fluoropyridine-2-sulfonamide
CID 114175143
N-(2-chloropropyl)-3-fluoropyridine-2-sulfonamide
CID 103308189
N-(2-amino-2-methylpropyl)-3-fluoropyridine-2-sulfonamide
CID 103302638
N-(2-bromobutyl)-3-fluoropyridine-2-sulfonamide
CID 103308428
N-(3-ethoxycyclobutyl)-3-fluoropyridine-2-sulfonamide
CID 114118992
N-benzyl-3-fluoropyridine-2-sulfonamide
CID 103299072
3-fluoro-N-[(4-methylphenyl)methyl]pyridine-2-sulfonamide
CID 103299052
N-(2-ethoxyphenyl)-3-fluoropyridine-2-sulfonamide
CID 103299090

Frequently Asked Questions

What is the IUPAC name of N-(2-ethoxyethyl)-3-fluoropyridine-2-sulfonamide?
The IUPAC name of N-(2-ethoxyethyl)-3-fluoropyridine-2-sulfonamide (CID 103299268) is N-(2-ethoxyethyl)-3-fluoropyridine-2-sulfonamide.
What is the SMILES notation for N-(2-ethoxyethyl)-3-fluoropyridine-2-sulfonamide?
The canonical SMILES for N-(2-ethoxyethyl)-3-fluoropyridine-2-sulfonamide is CCOCCNS(=O)(=O)c1ncccc1F.
What is the InChIKey of N-(2-ethoxyethyl)-3-fluoropyridine-2-sulfonamide?
The InChIKey is DOLNLZUDVKJQAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13FN2O3S/c1-2-15-7-6-12-16(13,14)9-8(10)4-3-5-11-9/h3-5,12H,2,6-7H2,1H3.
What are the key properties of N-(2-ethoxyethyl)-3-fluoropyridine-2-sulfonamide?
N-(2-ethoxyethyl)-3-fluoropyridine-2-sulfonamide has a molecular weight of 248.28 g/mol, XLogP of 0.54, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethoxyethyl)-3-fluoropyridine-2-sulfonamide is sourced from PubChem (CID 103299268), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).