4-amino-6-cyano-3-(difluoromethyl)pyridine-2-sulfonyl chloride

C7H4ClF2N3O2S — CID 118851281

IUPAC4-amino-6-cyano-3-(difluoromethyl)pyridine-2-sulfonyl chloride
SMILESN#Cc1cc(N)c(C(F)F)c(S(=O)(=O)Cl)n1
InChIInChI=1S/C7H4ClF2N3O2S/c8-16(14,15)7-5(6(9)10)4(12)1-3(2-11)13-7/h1,6H,(H2,12,13)
InChIKeySQCIVVWUACDOGQ-UHFFFAOYSA-N
MW267.64 g/mol
LogP1.40
Rot. Bonds2

About 4-amino-6-cyano-3-(difluoromethyl)pyridine-2-sulfonyl chloride

4-amino-6-cyano-3-(difluoromethyl)pyridine-2-sulfonyl chloride (PubChem CID 118851281) has the molecular formula C7H4ClF2N3O2S and a molecular weight of 267.64 g/mol. Its IUPAC name is 4-amino-6-cyano-3-(difluoromethyl)pyridine-2-sulfonyl chloride.

Molecular Properties

Compound Name4-amino-6-cyano-3-(difluoromethyl)pyridine-2-sulfonyl chloride
PubChem CID118851281
Molecular FormulaC7H4ClF2N3O2S
Molecular Weight267.64 g/mol
Exact Mass266.97
IUPAC Name4-amino-6-cyano-3-(difluoromethyl)pyridine-2-sulfonyl chloride
SMILESN#Cc1cc(N)c(C(F)F)c(S(=O)(=O)Cl)n1
InChIInChI=1S/C7H4ClF2N3O2S/c8-16(14,15)7-5(6(9)10)4(12)1-3(2-11)13-7/h1,6H,(H2,12,13)
InChIKeySQCIVVWUACDOGQ-UHFFFAOYSA-N
XLogP1.40
TPSA96.84 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.64
LogP ≤ 51.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4,6-diamino-5-(difluoromethyl)pyridine-2-carbonitrile
CID 130098584
6-cyano-4-(difluoromethyl)-3-iodopyridine-2-sulfonyl chloride
CID 130077741
4-bromo-6-cyano-3-(difluoromethyl)pyridine-2-sulfonamide
CID 118822647
4-amino-6-(aminomethyl)-5-(difluoromethyl)pyridine-2-carbonitrile
CID 118800135
3-amino-5-cyano-6-(difluoromethyl)pyridine-2-sulfonyl chloride
CID 130103729
4-amino-6-chloro-5-(difluoromethyl)pyridine-2-sulfonyl chloride
CID 118828999
4-chloro-3-(difluoromethyl)-6-methylpyridine-2-sulfonyl chloride
CID 130074573
5-amino-4-chloro-3-(difluoromethyl)pyridine-2-sulfonyl chloride
CID 130103084
5-cyano-3-(difluoromethyl)-4-fluoropyridine-2-sulfonyl chloride
CID 130076373
2-amino-6-cyano-3-(difluoromethyl)pyridine-4-carboxamide
CID 118995384
6-cyano-5-(difluoromethyl)-3-fluoropyridine-2-sulfonyl chloride
CID 130076337
4-cyano-6-(difluoromethyl)-3-nitropyridine-2-sulfonyl chloride
CID 118811093

Frequently Asked Questions

What is the IUPAC name of 4-amino-6-cyano-3-(difluoromethyl)pyridine-2-sulfonyl chloride?
The IUPAC name of 4-amino-6-cyano-3-(difluoromethyl)pyridine-2-sulfonyl chloride (CID 118851281) is 4-amino-6-cyano-3-(difluoromethyl)pyridine-2-sulfonyl chloride.
What is the SMILES notation for 4-amino-6-cyano-3-(difluoromethyl)pyridine-2-sulfonyl chloride?
The canonical SMILES for 4-amino-6-cyano-3-(difluoromethyl)pyridine-2-sulfonyl chloride is N#Cc1cc(N)c(C(F)F)c(S(=O)(=O)Cl)n1.
What is the InChIKey of 4-amino-6-cyano-3-(difluoromethyl)pyridine-2-sulfonyl chloride?
The InChIKey is SQCIVVWUACDOGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H4ClF2N3O2S/c8-16(14,15)7-5(6(9)10)4(12)1-3(2-11)13-7/h1,6H,(H2,12,13).
What are the key properties of 4-amino-6-cyano-3-(difluoromethyl)pyridine-2-sulfonyl chloride?
4-amino-6-cyano-3-(difluoromethyl)pyridine-2-sulfonyl chloride has a molecular weight of 267.64 g/mol, XLogP of 1.40, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-6-cyano-3-(difluoromethyl)pyridine-2-sulfonyl chloride is sourced from PubChem (CID 118851281), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).