3-fluoro-N-methyl-N-(1-methylsulfanylpropan-2-yl)pyridine-2-sulfonamide

C10H15FN2O2S2 — CID 103300378

IUPAC3-fluoro-N-methyl-N-(1-methylsulfanylpropan-2-yl)pyridine-2-sulfonamide
SMILESCSCC(C)N(C)S(=O)(=O)c1ncccc1F
InChIInChI=1S/C10H15FN2O2S2/c1-8(7-16-3)13(2)17(14,15)10-9(11)5-4-6-12-10/h4-6,8H,7H2,1-3H3
InChIKeyLPBBQYUXJSGCRL-UHFFFAOYSA-N
MW278.37 g/mol
LogP1.59
Rot. Bonds5

About 3-fluoro-N-methyl-N-(1-methylsulfanylpropan-2-yl)pyridine-2-sulfonamide

3-fluoro-N-methyl-N-(1-methylsulfanylpropan-2-yl)pyridine-2-sulfonamide (PubChem CID 103300378) has the molecular formula C10H15FN2O2S2 and a molecular weight of 278.37 g/mol. Its IUPAC name is 3-fluoro-N-methyl-N-(1-methylsulfanylpropan-2-yl)pyridine-2-sulfonamide.

Molecular Properties

Compound Name3-fluoro-N-methyl-N-(1-methylsulfanylpropan-2-yl)pyridine-2-sulfonamide
PubChem CID103300378
Molecular FormulaC10H15FN2O2S2
Molecular Weight278.37 g/mol
Exact Mass278.06
IUPAC Name3-fluoro-N-methyl-N-(1-methylsulfanylpropan-2-yl)pyridine-2-sulfonamide
SMILESCSCC(C)N(C)S(=O)(=O)c1ncccc1F
InChIInChI=1S/C10H15FN2O2S2/c1-8(7-16-3)13(2)17(14,15)10-9(11)5-4-6-12-10/h4-6,8H,7H2,1-3H3
InChIKeyLPBBQYUXJSGCRL-UHFFFAOYSA-N
XLogP1.59
TPSA50.27 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.37
LogP ≤ 51.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

N-[1-(3-aminophenyl)ethyl]-3-fluoro-N-methylpyridine-2-sulfonamide
CID 103298569
N-ethyl-3-fluoro-N-(2-fluorophenyl)pyridine-2-sulfonamide
CID 103299977
3-fluoro-N-[(2-fluorophenyl)methyl]-N-methylpyridine-2-sulfonamide
CID 103299462
3-fluoro-N,N-dipentylpyridine-2-sulfonamide
CID 103299737
3-fluoro-N-propan-2-yl-N-(pyridin-2-ylmethyl)pyridine-2-sulfonamide
CID 103299752
N-methyl-N-(4-methylpentan-2-yl)-3-(propylamino)pyridine-2-sulfonamide
CID 103305537
N-(3-aminopropyl)-3-fluoro-N-(2-methylpropyl)pyridine-2-sulfonamide
CID 103298483
3-fluoro-N',N'-dimethylpyridine-2-sulfonohydrazide
CID 103300356
3-fluoro-N-methyl-N-(2-methylphenyl)pyridine-2-sulfonamide
CID 103299973
N-cyclopropyl-3-fluoro-N-propylpyridine-2-sulfonamide
CID 103299212
5-(aminomethyl)-2-fluoro-N-methyl-N-(1-methylsulfanylpropan-2-yl)benzenesulfonamide
CID 112667435
ethyl 3-[(3-fluoro-2-pyridinyl)sulfonyl-methylamino]propanoate
CID 103299959

Frequently Asked Questions

What is the IUPAC name of 3-fluoro-N-methyl-N-(1-methylsulfanylpropan-2-yl)pyridine-2-sulfonamide?
The IUPAC name of 3-fluoro-N-methyl-N-(1-methylsulfanylpropan-2-yl)pyridine-2-sulfonamide (CID 103300378) is 3-fluoro-N-methyl-N-(1-methylsulfanylpropan-2-yl)pyridine-2-sulfonamide.
What is the SMILES notation for 3-fluoro-N-methyl-N-(1-methylsulfanylpropan-2-yl)pyridine-2-sulfonamide?
The canonical SMILES for 3-fluoro-N-methyl-N-(1-methylsulfanylpropan-2-yl)pyridine-2-sulfonamide is CSCC(C)N(C)S(=O)(=O)c1ncccc1F.
What is the InChIKey of 3-fluoro-N-methyl-N-(1-methylsulfanylpropan-2-yl)pyridine-2-sulfonamide?
The InChIKey is LPBBQYUXJSGCRL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15FN2O2S2/c1-8(7-16-3)13(2)17(14,15)10-9(11)5-4-6-12-10/h4-6,8H,7H2,1-3H3.
What are the key properties of 3-fluoro-N-methyl-N-(1-methylsulfanylpropan-2-yl)pyridine-2-sulfonamide?
3-fluoro-N-methyl-N-(1-methylsulfanylpropan-2-yl)pyridine-2-sulfonamide has a molecular weight of 278.37 g/mol, XLogP of 1.59, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-N-methyl-N-(1-methylsulfanylpropan-2-yl)pyridine-2-sulfonamide is sourced from PubChem (CID 103300378), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).