2-amino-5-cyano-6-(difluoromethyl)pyridine-3-sulfonamide

C7H6F2N4O2S — CID 119021912

IUPAC2-amino-5-cyano-6-(difluoromethyl)pyridine-3-sulfonamide
SMILESN#Cc1cc(S(N)(=O)=O)c(N)nc1C(F)F
InChIInChI=1S/C7H6F2N4O2S/c8-6(9)5-3(2-10)1-4(7(11)13-5)16(12,14)15/h1,6H,(H2,11,13)(H2,12,14,15)
InChIKeyKLIHENCYWNLZAR-UHFFFAOYSA-N
MW248.21 g/mol
LogP0.12
Rot. Bonds2

About 2-amino-5-cyano-6-(difluoromethyl)pyridine-3-sulfonamide

2-amino-5-cyano-6-(difluoromethyl)pyridine-3-sulfonamide (PubChem CID 119021912) has the molecular formula C7H6F2N4O2S and a molecular weight of 248.21 g/mol. Its IUPAC name is 2-amino-5-cyano-6-(difluoromethyl)pyridine-3-sulfonamide.

Molecular Properties

Compound Name2-amino-5-cyano-6-(difluoromethyl)pyridine-3-sulfonamide
PubChem CID119021912
Molecular FormulaC7H6F2N4O2S
Molecular Weight248.21 g/mol
Exact Mass248.02
IUPAC Name2-amino-5-cyano-6-(difluoromethyl)pyridine-3-sulfonamide
SMILESN#Cc1cc(S(N)(=O)=O)c(N)nc1C(F)F
InChIInChI=1S/C7H6F2N4O2S/c8-6(9)5-3(2-10)1-4(7(11)13-5)16(12,14)15/h1,6H,(H2,11,13)(H2,12,14,15)
InChIKeyKLIHENCYWNLZAR-UHFFFAOYSA-N
XLogP0.12
TPSA122.86 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.21
LogP ≤ 50.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

6-amino-2-(difluoromethyl)-5-iodopyridine-3-carbonitrile
CID 119004899
5-amino-2-cyano-6-(difluoromethyl)pyridine-3-sulfonamide
CID 130103775
3-amino-5-cyano-6-(difluoromethyl)pyridine-2-sulfonyl chloride
CID 130103729
6-chloro-4-cyano-2-(difluoromethyl)pyridine-3-sulfonamide
CID 130071480
5-amino-2-(difluoromethyl)-6-fluoropyridine-3-carbonitrile
CID 130103195
5-cyano-6-(difluoromethyl)-2-methoxypyridine-3-sulfonyl chloride
CID 131459192
3-cyano-6-(difluoromethyl)-5-iodopyridine-2-sulfonamide
CID 130077820
5-chloro-2-cyano-6-(difluoromethyl)pyridine-3-sulfonamide
CID 134685410
6-cyano-2-(difluoromethyl)-3-nitropyridine-4-sulfonamide
CID 134675468
6-amino-2-cyano-3-(difluoromethyl)pyridine-4-sulfonamide
CID 130103745
2-(difluoromethyl)-6-fluoro-5-hydroxypyridine-3-carbonitrile
CID 130075872
5-amino-6-bromo-2-(difluoromethyl)pyridine-3-sulfonamide
CID 130102347

Frequently Asked Questions

What is the IUPAC name of 2-amino-5-cyano-6-(difluoromethyl)pyridine-3-sulfonamide?
The IUPAC name of 2-amino-5-cyano-6-(difluoromethyl)pyridine-3-sulfonamide (CID 119021912) is 2-amino-5-cyano-6-(difluoromethyl)pyridine-3-sulfonamide.
What is the SMILES notation for 2-amino-5-cyano-6-(difluoromethyl)pyridine-3-sulfonamide?
The canonical SMILES for 2-amino-5-cyano-6-(difluoromethyl)pyridine-3-sulfonamide is N#Cc1cc(S(N)(=O)=O)c(N)nc1C(F)F.
What is the InChIKey of 2-amino-5-cyano-6-(difluoromethyl)pyridine-3-sulfonamide?
The InChIKey is KLIHENCYWNLZAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6F2N4O2S/c8-6(9)5-3(2-10)1-4(7(11)13-5)16(12,14)15/h1,6H,(H2,11,13)(H2,12,14,15).
What are the key properties of 2-amino-5-cyano-6-(difluoromethyl)pyridine-3-sulfonamide?
2-amino-5-cyano-6-(difluoromethyl)pyridine-3-sulfonamide has a molecular weight of 248.21 g/mol, XLogP of 0.12, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-5-cyano-6-(difluoromethyl)pyridine-3-sulfonamide is sourced from PubChem (CID 119021912), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).