4-amino-5-chloro-6-(difluoromethyl)pyridine-3-sulfonamide

C6H6ClF2N3O2S — CID 118817790

IUPAC4-amino-5-chloro-6-(difluoromethyl)pyridine-3-sulfonamide
SMILESNc1c(S(N)(=O)=O)cnc(C(F)F)c1Cl
InChIInChI=1S/C6H6ClF2N3O2S/c7-3-4(10)2(15(11,13)14)1-12-5(3)6(8)9/h1,6H,(H2,10,12)(H2,11,13,14)
InChIKeyURSQXAVLJNUURF-UHFFFAOYSA-N
MW257.65 g/mol
LogP0.90
Rot. Bonds2

About 4-amino-5-chloro-6-(difluoromethyl)pyridine-3-sulfonamide

4-amino-5-chloro-6-(difluoromethyl)pyridine-3-sulfonamide (PubChem CID 118817790) has the molecular formula C6H6ClF2N3O2S and a molecular weight of 257.65 g/mol. Its IUPAC name is 4-amino-5-chloro-6-(difluoromethyl)pyridine-3-sulfonamide.

Molecular Properties

Compound Name4-amino-5-chloro-6-(difluoromethyl)pyridine-3-sulfonamide
PubChem CID118817790
Molecular FormulaC6H6ClF2N3O2S
Molecular Weight257.65 g/mol
Exact Mass256.98
IUPAC Name4-amino-5-chloro-6-(difluoromethyl)pyridine-3-sulfonamide
SMILESNc1c(S(N)(=O)=O)cnc(C(F)F)c1Cl
InChIInChI=1S/C6H6ClF2N3O2S/c7-3-4(10)2(15(11,13)14)1-12-5(3)6(8)9/h1,6H,(H2,10,12)(H2,11,13,14)
InChIKeyURSQXAVLJNUURF-UHFFFAOYSA-N
XLogP0.90
TPSA99.07 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.65
LogP ≤ 50.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-amino-6-(difluoromethyl)-5-methylpyridine-3-sulfonamide
CID 118800250
5-chloro-6-(difluoromethyl)-4-methoxypyridine-3-sulfonamide
CID 134686410
6-amino-4-chloro-5-(difluoromethyl)pyridine-3-sulfonamide
CID 119016728
6-(difluoromethyl)-4-fluoro-5-methylpyridine-3-sulfonamide
CID 118854245
4-amino-6-bromo-5-(difluoromethyl)pyridine-3-sulfonamide
CID 118817717
2-(difluoromethyl)-5-fluoropyridine-3-sulfonamide
CID 118854230
5-bromo-2-(difluoromethyl)pyridine-3-sulfonamide
CID 130095356
4-chloro-5-(difluoromethyl)-6-methylpyridine-3-sulfonamide
CID 130074592
6-bromo-4-chloro-5-(difluoromethyl)pyridine-3-sulfonamide
CID 119001281
4-chloro-6-(difluoromethyl)pyridine-3-sulfonamide
CID 130095772
2-(difluoromethyl)-5-hydroxypyridine-3-sulfonamide
CID 118848760
5-chloro-6-cyano-4-(difluoromethyl)pyridine-3-sulfonamide
CID 134685278

Frequently Asked Questions

What is the IUPAC name of 4-amino-5-chloro-6-(difluoromethyl)pyridine-3-sulfonamide?
The IUPAC name of 4-amino-5-chloro-6-(difluoromethyl)pyridine-3-sulfonamide (CID 118817790) is 4-amino-5-chloro-6-(difluoromethyl)pyridine-3-sulfonamide.
What is the SMILES notation for 4-amino-5-chloro-6-(difluoromethyl)pyridine-3-sulfonamide?
The canonical SMILES for 4-amino-5-chloro-6-(difluoromethyl)pyridine-3-sulfonamide is Nc1c(S(N)(=O)=O)cnc(C(F)F)c1Cl.
What is the InChIKey of 4-amino-5-chloro-6-(difluoromethyl)pyridine-3-sulfonamide?
The InChIKey is URSQXAVLJNUURF-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H6ClF2N3O2S/c7-3-4(10)2(15(11,13)14)1-12-5(3)6(8)9/h1,6H,(H2,10,12)(H2,11,13,14).
What are the key properties of 4-amino-5-chloro-6-(difluoromethyl)pyridine-3-sulfonamide?
4-amino-5-chloro-6-(difluoromethyl)pyridine-3-sulfonamide has a molecular weight of 257.65 g/mol, XLogP of 0.90, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-5-chloro-6-(difluoromethyl)pyridine-3-sulfonamide is sourced from PubChem (CID 118817790), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).