3-[(3-fluoro-2-pyridinyl)sulfonylamino]-N,2,2-trimethylpropanamide

C11H16FN3O3S — CID 114167235

IUPAC3-[(3-fluoro-2-pyridinyl)sulfonylamino]-N,2,2-trimethylpropanamide
SMILESCNC(=O)C(C)(C)CNS(=O)(=O)c1ncccc1F
InChIInChI=1S/C11H16FN3O3S/c1-11(2,10(16)13-3)7-15-19(17,18)9-8(12)5-4-6-14-9/h4-6,15H,7H2,1-3H3,(H,13,16)
InChIKeyHZBQJRRNLCFJNF-UHFFFAOYSA-N
MW289.33 g/mol
LogP0.27
Rot. Bonds5

About 3-[(3-fluoro-2-pyridinyl)sulfonylamino]-N,2,2-trimethylpropanamide

3-[(3-fluoro-2-pyridinyl)sulfonylamino]-N,2,2-trimethylpropanamide (PubChem CID 114167235) has the molecular formula C11H16FN3O3S and a molecular weight of 289.33 g/mol. Its IUPAC name is 3-[(3-fluoro-2-pyridinyl)sulfonylamino]-N,2,2-trimethylpropanamide.

Molecular Properties

Compound Name3-[(3-fluoro-2-pyridinyl)sulfonylamino]-N,2,2-trimethylpropanamide
PubChem CID114167235
Molecular FormulaC11H16FN3O3S
Molecular Weight289.33 g/mol
Exact Mass289.09
IUPAC Name3-[(3-fluoro-2-pyridinyl)sulfonylamino]-N,2,2-trimethylpropanamide
SMILESCNC(=O)C(C)(C)CNS(=O)(=O)c1ncccc1F
InChIInChI=1S/C11H16FN3O3S/c1-11(2,10(16)13-3)7-15-19(17,18)9-8(12)5-4-6-14-9/h4-6,15H,7H2,1-3H3,(H,13,16)
InChIKeyHZBQJRRNLCFJNF-UHFFFAOYSA-N
XLogP0.27
TPSA88.16 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.33
LogP ≤ 50.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-amino-2-methylpropyl)-3-fluoropyridine-2-sulfonamide
CID 103302638
ethyl 2-[(3-fluoro-2-pyridinyl)sulfonylamino]acetate
CID 103299284
N-(2-ethyl-2-methylsulfanylbutyl)-3-fluoropyridine-2-sulfonamide
CID 114115952
2-[[(3-fluoro-2-pyridinyl)sulfonylamino]methyl]-3-methylbutanoic acid
CID 103298831
N-(1-bromo-2-methylpropan-2-yl)-3-fluoropyridine-2-sulfonamide
CID 103308364
N-(2-chloropropyl)-3-fluoropyridine-2-sulfonamide
CID 103308189
N-(2-bromobutyl)-3-fluoropyridine-2-sulfonamide
CID 103308428
3-fluoro-N-(3-hydroxy-2-methylpropyl)pyridine-2-sulfonamide
CID 103300164
N-(2-amino-4,4-dimethylpentyl)-3-fluoropyridine-2-sulfonamide
CID 107158974
3-fluoro-N-[(2-hydroxyphenyl)methyl]pyridine-2-sulfonamide
CID 103300513
4-[(3-fluoro-2-pyridinyl)sulfonylamino]-2-hydroxybutanoic acid
CID 114006728
3-[(4-hydrazinyl-3-pyridinyl)sulfonylamino]-N,2,2-trimethylpropanamide
CID 106278343

Frequently Asked Questions

What is the IUPAC name of 3-[(3-fluoro-2-pyridinyl)sulfonylamino]-N,2,2-trimethylpropanamide?
The IUPAC name of 3-[(3-fluoro-2-pyridinyl)sulfonylamino]-N,2,2-trimethylpropanamide (CID 114167235) is 3-[(3-fluoro-2-pyridinyl)sulfonylamino]-N,2,2-trimethylpropanamide.
What is the SMILES notation for 3-[(3-fluoro-2-pyridinyl)sulfonylamino]-N,2,2-trimethylpropanamide?
The canonical SMILES for 3-[(3-fluoro-2-pyridinyl)sulfonylamino]-N,2,2-trimethylpropanamide is CNC(=O)C(C)(C)CNS(=O)(=O)c1ncccc1F.
What is the InChIKey of 3-[(3-fluoro-2-pyridinyl)sulfonylamino]-N,2,2-trimethylpropanamide?
The InChIKey is HZBQJRRNLCFJNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16FN3O3S/c1-11(2,10(16)13-3)7-15-19(17,18)9-8(12)5-4-6-14-9/h4-6,15H,7H2,1-3H3,(H,13,16).
What are the key properties of 3-[(3-fluoro-2-pyridinyl)sulfonylamino]-N,2,2-trimethylpropanamide?
3-[(3-fluoro-2-pyridinyl)sulfonylamino]-N,2,2-trimethylpropanamide has a molecular weight of 289.33 g/mol, XLogP of 0.27, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(3-fluoro-2-pyridinyl)sulfonylamino]-N,2,2-trimethylpropanamide is sourced from PubChem (CID 114167235), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).