N-(2,6-difluoro-3-pyridinyl)methanesulfonamide

C6H6F2N2O2S — CID 103098097

IUPACN-(2,6-difluoro-3-pyridinyl)methanesulfonamide
SMILESCS(=O)(=O)Nc1ccc(F)nc1F
InChIInChI=1S/C6H6F2N2O2S/c1-13(11,12)10-4-2-3-5(7)9-6(4)8/h2-3,10H,1H3
InChIKeyLNTZMJFQHJPOFS-UHFFFAOYSA-N
MW208.19 g/mol
LogP0.73
Rot. Bonds2

About N-(2,6-difluoro-3-pyridinyl)methanesulfonamide

N-(2,6-difluoro-3-pyridinyl)methanesulfonamide (PubChem CID 103098097) has the molecular formula C6H6F2N2O2S and a molecular weight of 208.19 g/mol. Its IUPAC name is N-(2,6-difluoro-3-pyridinyl)methanesulfonamide.

Molecular Properties

Compound NameN-(2,6-difluoro-3-pyridinyl)methanesulfonamide
PubChem CID103098097
Molecular FormulaC6H6F2N2O2S
Molecular Weight208.19 g/mol
Exact Mass208.01
IUPAC NameN-(2,6-difluoro-3-pyridinyl)methanesulfonamide
SMILESCS(=O)(=O)Nc1ccc(F)nc1F
InChIInChI=1S/C6H6F2N2O2S/c1-13(11,12)10-4-2-3-5(7)9-6(4)8/h2-3,10H,1H3
InChIKeyLNTZMJFQHJPOFS-UHFFFAOYSA-N
XLogP0.73
TPSA59.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.19
LogP ≤ 50.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-(2,6-difluoro-3-pyridinyl)-1-methylsulfonylmethanesulfonamide
CID 103098172
N-(2,6-difluoro-3-pyridinyl)-2-methylsulfonylacetamide
CID 103097646
N-(2,6-difluoro-3-pyridinyl)piperidine-1-sulfonamide
CID 103098209
2-chloro-N-(2,6-difluoro-3-pyridinyl)-4-methylbenzenesulfonamide
CID 103098259
N-(2,6-difluoro-3-pyridinyl)-2-methoxy-5-methylbenzenesulfonamide
CID 103098110
N-(2,6-difluoro-3-pyridinyl)-2-pyridin-2-ylethanesulfonamide
CID 103098114
N-(2-fluoro-4-hydroxyphenyl)methanesulfonamide
CID 64786305
N-(2-chloro-6-methyl-3-pyridinyl)methanesulfonamide
CID 126989322
N-(2-fluoro-5-methylphenyl)methanesulfonamide
CID 3847750
N-[5-fluoro-2-(methanesulfonamido)phenyl]acetamide
CID 113093308
N-[2-fluoro-4-[(E)-prop-1-enyl]phenyl]methanesulfonamide
CID 59156661
N-(4-fluoro-2-isocyanatophenyl)methanesulfonamide
CID 169352536

Frequently Asked Questions

What is the IUPAC name of N-(2,6-difluoro-3-pyridinyl)methanesulfonamide?
The IUPAC name of N-(2,6-difluoro-3-pyridinyl)methanesulfonamide (CID 103098097) is N-(2,6-difluoro-3-pyridinyl)methanesulfonamide.
What is the SMILES notation for N-(2,6-difluoro-3-pyridinyl)methanesulfonamide?
The canonical SMILES for N-(2,6-difluoro-3-pyridinyl)methanesulfonamide is CS(=O)(=O)Nc1ccc(F)nc1F.
What is the InChIKey of N-(2,6-difluoro-3-pyridinyl)methanesulfonamide?
The InChIKey is LNTZMJFQHJPOFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H6F2N2O2S/c1-13(11,12)10-4-2-3-5(7)9-6(4)8/h2-3,10H,1H3.
What are the key properties of N-(2,6-difluoro-3-pyridinyl)methanesulfonamide?
N-(2,6-difluoro-3-pyridinyl)methanesulfonamide has a molecular weight of 208.19 g/mol, XLogP of 0.73, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-difluoro-3-pyridinyl)methanesulfonamide is sourced from PubChem (CID 103098097), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).