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

C7H7ClF2N2O3S — CID 134686410

IUPAC5-chloro-6-(difluoromethyl)-4-methoxypyridine-3-sulfonamide
SMILESCOc1c(S(N)(=O)=O)cnc(C(F)F)c1Cl
InChIInChI=1S/C7H7ClF2N2O3S/c1-15-6-3(16(11,13)14)2-12-5(4(6)8)7(9)10/h2,7H,1H3,(H2,11,13,14)
InChIKeyIUQBKUVVPCKEQY-UHFFFAOYSA-N
MW272.66 g/mol
LogP1.33
Rot. Bonds3

About 5-chloro-6-(difluoromethyl)-4-methoxypyridine-3-sulfonamide

5-chloro-6-(difluoromethyl)-4-methoxypyridine-3-sulfonamide (PubChem CID 134686410) has the molecular formula C7H7ClF2N2O3S and a molecular weight of 272.66 g/mol. Its IUPAC name is 5-chloro-6-(difluoromethyl)-4-methoxypyridine-3-sulfonamide.

Molecular Properties

Compound Name5-chloro-6-(difluoromethyl)-4-methoxypyridine-3-sulfonamide
PubChem CID134686410
Molecular FormulaC7H7ClF2N2O3S
Molecular Weight272.66 g/mol
Exact Mass271.98
IUPAC Name5-chloro-6-(difluoromethyl)-4-methoxypyridine-3-sulfonamide
SMILESCOc1c(S(N)(=O)=O)cnc(C(F)F)c1Cl
InChIInChI=1S/C7H7ClF2N2O3S/c1-15-6-3(16(11,13)14)2-12-5(4(6)8)7(9)10/h2,7H,1H3,(H2,11,13,14)
InChIKeyIUQBKUVVPCKEQY-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

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Related Compounds

4-amino-5-chloro-6-(difluoromethyl)pyridine-3-sulfonamide
CID 118817790
5-(difluoromethyl)-4-methoxy-6-methylpyridine-3-sulfonamide
CID 133098987
2-(difluoromethyl)-5-fluoro-3-methoxypyridine-4-sulfonamide
CID 118820670
6-(difluoromethyl)-5-hydroxy-4-methoxypyridine-3-sulfonyl chloride
CID 118849103
[5-chloro-6-(difluoromethyl)-4-methoxy-3-pyridinyl]methanol
CID 130073877
5-(bromomethyl)-3-chloro-2-(difluoromethyl)-4-methoxypyridine
CID 130073771
4-amino-6-(difluoromethyl)-5-methylpyridine-3-sulfonamide
CID 118800250
6-(difluoromethyl)-4-fluoro-5-methylpyridine-3-sulfonamide
CID 118854245
4-chloro-5-(difluoromethyl)-6-methylpyridine-3-sulfonamide
CID 130074592
6-cyano-4-(difluoromethyl)-5-methoxypyridine-3-sulfonamide
CID 119012646
6-bromo-2-(difluoromethyl)-3-methoxypyridine-4-sulfonamide
CID 130069045
5-bromo-2-(difluoromethyl)-3-methoxypyridine-4-sulfonyl chloride
CID 130069032

Frequently Asked Questions

What is the IUPAC name of 5-chloro-6-(difluoromethyl)-4-methoxypyridine-3-sulfonamide?
The IUPAC name of 5-chloro-6-(difluoromethyl)-4-methoxypyridine-3-sulfonamide (CID 134686410) is 5-chloro-6-(difluoromethyl)-4-methoxypyridine-3-sulfonamide.
What is the SMILES notation for 5-chloro-6-(difluoromethyl)-4-methoxypyridine-3-sulfonamide?
The canonical SMILES for 5-chloro-6-(difluoromethyl)-4-methoxypyridine-3-sulfonamide is COc1c(S(N)(=O)=O)cnc(C(F)F)c1Cl.
What is the InChIKey of 5-chloro-6-(difluoromethyl)-4-methoxypyridine-3-sulfonamide?
The InChIKey is IUQBKUVVPCKEQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7ClF2N2O3S/c1-15-6-3(16(11,13)14)2-12-5(4(6)8)7(9)10/h2,7H,1H3,(H2,11,13,14).
What are the key properties of 5-chloro-6-(difluoromethyl)-4-methoxypyridine-3-sulfonamide?
5-chloro-6-(difluoromethyl)-4-methoxypyridine-3-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 5-chloro-6-(difluoromethyl)-4-methoxypyridine-3-sulfonamide is sourced from PubChem (CID 134686410), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).