6-(difluoromethyl)-3-methoxy-2-methylpyridine-4-sulfonamide

C8H10F2N2O3S — CID 133098978

IUPAC6-(difluoromethyl)-3-methoxy-2-methylpyridine-4-sulfonamide
SMILESCOc1c(S(N)(=O)=O)cc(C(F)F)nc1C
InChIInChI=1S/C8H10F2N2O3S/c1-4-7(15-2)6(16(11,13)14)3-5(12-4)8(9)10/h3,8H,1-2H3,(H2,11,13,14)
InChIKeySYVSENKYCONKFK-UHFFFAOYSA-N
MW252.24 g/mol
LogP0.98
Rot. Bonds3

About 6-(difluoromethyl)-3-methoxy-2-methylpyridine-4-sulfonamide

6-(difluoromethyl)-3-methoxy-2-methylpyridine-4-sulfonamide (PubChem CID 133098978) has the molecular formula C8H10F2N2O3S and a molecular weight of 252.24 g/mol. Its IUPAC name is 6-(difluoromethyl)-3-methoxy-2-methylpyridine-4-sulfonamide.

Molecular Properties

Compound Name6-(difluoromethyl)-3-methoxy-2-methylpyridine-4-sulfonamide
PubChem CID133098978
Molecular FormulaC8H10F2N2O3S
Molecular Weight252.24 g/mol
Exact Mass252.04
IUPAC Name6-(difluoromethyl)-3-methoxy-2-methylpyridine-4-sulfonamide
SMILESCOc1c(S(N)(=O)=O)cc(C(F)F)nc1C
InChIInChI=1S/C8H10F2N2O3S/c1-4-7(15-2)6(16(11,13)14)3-5(12-4)8(9)10/h3,8H,1-2H3,(H2,11,13,14)
InChIKeySYVSENKYCONKFK-UHFFFAOYSA-N
XLogP0.98
TPSA82.28 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.24
LogP ≤ 50.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-(difluoromethyl)-3-methoxy-2-methylpyridine-4-sulfonamide?
The IUPAC name of 6-(difluoromethyl)-3-methoxy-2-methylpyridine-4-sulfonamide (CID 133098978) is 6-(difluoromethyl)-3-methoxy-2-methylpyridine-4-sulfonamide.
What is the SMILES notation for 6-(difluoromethyl)-3-methoxy-2-methylpyridine-4-sulfonamide?
The canonical SMILES for 6-(difluoromethyl)-3-methoxy-2-methylpyridine-4-sulfonamide is COc1c(S(N)(=O)=O)cc(C(F)F)nc1C.
What is the InChIKey of 6-(difluoromethyl)-3-methoxy-2-methylpyridine-4-sulfonamide?
The InChIKey is SYVSENKYCONKFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10F2N2O3S/c1-4-7(15-2)6(16(11,13)14)3-5(12-4)8(9)10/h3,8H,1-2H3,(H2,11,13,14).
What are the key properties of 6-(difluoromethyl)-3-methoxy-2-methylpyridine-4-sulfonamide?
6-(difluoromethyl)-3-methoxy-2-methylpyridine-4-sulfonamide has a molecular weight of 252.24 g/mol, XLogP of 0.98, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(difluoromethyl)-3-methoxy-2-methylpyridine-4-sulfonamide is sourced from PubChem (CID 133098978), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).