6-amino-4-(difluoromethyl)-5-fluoropyridine-2-sulfonyl chloride

C6H4ClF3N2O2S — CID 130104394

IUPAC6-amino-4-(difluoromethyl)-5-fluoropyridine-2-sulfonyl chloride
SMILESNc1nc(S(=O)(=O)Cl)cc(C(F)F)c1F
InChIInChI=1S/C6H4ClF3N2O2S/c7-15(13,14)3-1-2(5(9)10)4(8)6(11)12-3/h1,5H,(H2,11,12)
InChIKeyIXQSTLGKOFYRIF-UHFFFAOYSA-N
MW260.62 g/mol
LogP1.67
Rot. Bonds2

About 6-amino-4-(difluoromethyl)-5-fluoropyridine-2-sulfonyl chloride

6-amino-4-(difluoromethyl)-5-fluoropyridine-2-sulfonyl chloride (PubChem CID 130104394) has the molecular formula C6H4ClF3N2O2S and a molecular weight of 260.62 g/mol. Its IUPAC name is 6-amino-4-(difluoromethyl)-5-fluoropyridine-2-sulfonyl chloride.

Molecular Properties

Compound Name6-amino-4-(difluoromethyl)-5-fluoropyridine-2-sulfonyl chloride
PubChem CID130104394
Molecular FormulaC6H4ClF3N2O2S
Molecular Weight260.62 g/mol
Exact Mass259.96
IUPAC Name6-amino-4-(difluoromethyl)-5-fluoropyridine-2-sulfonyl chloride
SMILESNc1nc(S(=O)(=O)Cl)cc(C(F)F)c1F
InChIInChI=1S/C6H4ClF3N2O2S/c7-15(13,14)3-1-2(5(9)10)4(8)6(11)12-3/h1,5H,(H2,11,12)
InChIKeyIXQSTLGKOFYRIF-UHFFFAOYSA-N
XLogP1.67
TPSA73.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.62
LogP ≤ 51.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5,6-diamino-4-(difluoromethyl)pyridine-2-sulfonamide
CID 118803869
6-(difluoromethyl)-4,5-difluoropyridine-2-sulfonyl chloride
CID 130099948
6-bromo-4-(difluoromethyl)-5-methoxypyridine-2-sulfonyl chloride
CID 130068995
4-(difluoromethyl)-5,6-dimethoxypyridine-2-sulfonyl chloride
CID 118824318
6-amino-5-chloro-3-(difluoromethyl)pyridine-2-sulfonyl chloride
CID 130103054
4-amino-6-chloro-5-(difluoromethyl)pyridine-2-sulfonyl chloride
CID 118828999
5-amino-4-bromo-6-(difluoromethyl)pyridine-2-sulfonyl chloride
CID 130102315
6-bromo-4-(difluoromethyl)-5-nitropyridine-2-sulfonyl chloride
CID 131314338
5-(difluoromethyl)-2-fluoropyridine-4-sulfonyl chloride
CID 130096580
4-chloro-6-(difluoromethyl)pyridine-2-sulfonyl chloride
CID 118834021
6-amino-2-cyano-5-(difluoromethyl)pyridine-3-sulfonyl chloride
CID 130103708
4-amino-5-(difluoromethyl)-6-methoxypyridine-2-sulfonyl chloride
CID 118806455

Frequently Asked Questions

What is the IUPAC name of 6-amino-4-(difluoromethyl)-5-fluoropyridine-2-sulfonyl chloride?
The IUPAC name of 6-amino-4-(difluoromethyl)-5-fluoropyridine-2-sulfonyl chloride (CID 130104394) is 6-amino-4-(difluoromethyl)-5-fluoropyridine-2-sulfonyl chloride.
What is the SMILES notation for 6-amino-4-(difluoromethyl)-5-fluoropyridine-2-sulfonyl chloride?
The canonical SMILES for 6-amino-4-(difluoromethyl)-5-fluoropyridine-2-sulfonyl chloride is Nc1nc(S(=O)(=O)Cl)cc(C(F)F)c1F.
What is the InChIKey of 6-amino-4-(difluoromethyl)-5-fluoropyridine-2-sulfonyl chloride?
The InChIKey is IXQSTLGKOFYRIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H4ClF3N2O2S/c7-15(13,14)3-1-2(5(9)10)4(8)6(11)12-3/h1,5H,(H2,11,12).
What are the key properties of 6-amino-4-(difluoromethyl)-5-fluoropyridine-2-sulfonyl chloride?
6-amino-4-(difluoromethyl)-5-fluoropyridine-2-sulfonyl chloride has a molecular weight of 260.62 g/mol, XLogP of 1.67, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-4-(difluoromethyl)-5-fluoropyridine-2-sulfonyl chloride is sourced from PubChem (CID 130104394), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).