6-chloro-3-(difluoromethyl)-4-methoxypyridine-2-sulfonamide

C7H7ClF2N2O3S — CID 130074043

IUPAC6-chloro-3-(difluoromethyl)-4-methoxypyridine-2-sulfonamide
SMILESCOc1cc(Cl)nc(S(N)(=O)=O)c1C(F)F
InChIInChI=1S/C7H7ClF2N2O3S/c1-15-3-2-4(8)12-7(16(11,13)14)5(3)6(9)10/h2,6H,1H3,(H2,11,13,14)
InChIKeyFBSJDKYLIMBVBA-UHFFFAOYSA-N
MW272.66 g/mol
LogP1.33
Rot. Bonds3

About 6-chloro-3-(difluoromethyl)-4-methoxypyridine-2-sulfonamide

6-chloro-3-(difluoromethyl)-4-methoxypyridine-2-sulfonamide (PubChem CID 130074043) has the molecular formula C7H7ClF2N2O3S and a molecular weight of 272.66 g/mol. Its IUPAC name is 6-chloro-3-(difluoromethyl)-4-methoxypyridine-2-sulfonamide.

Molecular Properties

Compound Name6-chloro-3-(difluoromethyl)-4-methoxypyridine-2-sulfonamide
PubChem CID130074043
Molecular FormulaC7H7ClF2N2O3S
Molecular Weight272.66 g/mol
Exact Mass271.98
IUPAC Name6-chloro-3-(difluoromethyl)-4-methoxypyridine-2-sulfonamide
SMILESCOc1cc(Cl)nc(S(N)(=O)=O)c1C(F)F
InChIInChI=1S/C7H7ClF2N2O3S/c1-15-3-2-4(8)12-7(16(11,13)14)5(3)6(9)10/h2,6H,1H3,(H2,11,13,14)
InChIKeyFBSJDKYLIMBVBA-UHFFFAOYSA-N
XLogP1.33
TPSA82.28 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.66
LogP ≤ 51.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

3-(difluoromethyl)-4-methoxy-6-nitropyridine-2-sulfonamide
CID 133087613
3-(difluoromethyl)-4-fluoro-6-methoxypyridine-2-sulfonamide
CID 133105151
3-(difluoromethyl)-4-iodo-6-methoxypyridine-2-sulfonamide
CID 130085864
5-chloro-3-(difluoromethyl)-6-methoxypyridine-2-sulfonamide
CID 134669477
6-chloro-5-(difluoromethyl)-4-methoxypyridin-2-amine
CID 130102534
3-(difluoromethyl)-4-methoxy-6-oxo-1H-pyridine-2-sulfonamide
CID 130083567
6-bromo-3-(difluoromethyl)-4-methylpyridine-2-sulfonamide
CID 130069630
2,6-dichloro-4-methoxy-3-propan-2-ylpyridine
CID 146431908
3-(difluoromethyl)-4,6-diiodopyridine-2-sulfonamide
CID 134677678
6-amino-4-bromo-3-(difluoromethyl)pyridine-2-sulfonamide
CID 130102335
3-chloro-6-(difluoromethyl)-4-fluoropyridine-2-sulfonamide
CID 134663670
6-chloro-5-(difluoromethyl)-4-methoxypyridine-2-carbaldehyde
CID 130073904

Frequently Asked Questions

What is the IUPAC name of 6-chloro-3-(difluoromethyl)-4-methoxypyridine-2-sulfonamide?
The IUPAC name of 6-chloro-3-(difluoromethyl)-4-methoxypyridine-2-sulfonamide (CID 130074043) is 6-chloro-3-(difluoromethyl)-4-methoxypyridine-2-sulfonamide.
What is the SMILES notation for 6-chloro-3-(difluoromethyl)-4-methoxypyridine-2-sulfonamide?
The canonical SMILES for 6-chloro-3-(difluoromethyl)-4-methoxypyridine-2-sulfonamide is COc1cc(Cl)nc(S(N)(=O)=O)c1C(F)F.
What is the InChIKey of 6-chloro-3-(difluoromethyl)-4-methoxypyridine-2-sulfonamide?
The InChIKey is FBSJDKYLIMBVBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7ClF2N2O3S/c1-15-3-2-4(8)12-7(16(11,13)14)5(3)6(9)10/h2,6H,1H3,(H2,11,13,14).
What are the key properties of 6-chloro-3-(difluoromethyl)-4-methoxypyridine-2-sulfonamide?
6-chloro-3-(difluoromethyl)-4-methoxypyridine-2-sulfonamide has a molecular weight of 272.66 g/mol, XLogP of 1.33, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-3-(difluoromethyl)-4-methoxypyridine-2-sulfonamide is sourced from PubChem (CID 130074043), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).