5-amino-4-chloro-3-(difluoromethyl)pyridine-2-sulfonyl chloride

C6H4Cl2F2N2O2S — CID 130103084

IUPAC5-amino-4-chloro-3-(difluoromethyl)pyridine-2-sulfonyl chloride
SMILESNc1cnc(S(=O)(=O)Cl)c(C(F)F)c1Cl
InChIInChI=1S/C6H4Cl2F2N2O2S/c7-4-2(11)1-12-6(15(8,13)14)3(4)5(9)10/h1,5H,11H2
InChIKeyTZVIKJABYTUZAU-UHFFFAOYSA-N
MW277.08 g/mol
LogP2.18
Rot. Bonds2

About 5-amino-4-chloro-3-(difluoromethyl)pyridine-2-sulfonyl chloride

5-amino-4-chloro-3-(difluoromethyl)pyridine-2-sulfonyl chloride (PubChem CID 130103084) has the molecular formula C6H4Cl2F2N2O2S and a molecular weight of 277.08 g/mol. Its IUPAC name is 5-amino-4-chloro-3-(difluoromethyl)pyridine-2-sulfonyl chloride.

Molecular Properties

Compound Name5-amino-4-chloro-3-(difluoromethyl)pyridine-2-sulfonyl chloride
PubChem CID130103084
Molecular FormulaC6H4Cl2F2N2O2S
Molecular Weight277.08 g/mol
Exact Mass275.93
IUPAC Name5-amino-4-chloro-3-(difluoromethyl)pyridine-2-sulfonyl chloride
SMILESNc1cnc(S(=O)(=O)Cl)c(C(F)F)c1Cl
InChIInChI=1S/C6H4Cl2F2N2O2S/c7-4-2(11)1-12-6(15(8,13)14)3(4)5(9)10/h1,5H,11H2
InChIKeyTZVIKJABYTUZAU-UHFFFAOYSA-N
XLogP2.18
TPSA73.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.08
LogP ≤ 52.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-chloro-4-(difluoromethyl)-3-fluoropyridine-2-sulfonyl chloride
CID 130072158
5-amino-2-chloro-4-(difluoromethyl)pyridine-3-sulfonamide
CID 130103132
4-chloro-3-(difluoromethyl)-5-fluoropyridine-2-sulfonamide
CID 118810599
3-chloro-5-(difluoromethyl)-4-fluoropyridine-2-sulfonyl chloride
CID 130072163
4-bromo-3-(difluoromethyl)-5-iodopyridine-2-sulfonyl chloride
CID 118822917
4-chloro-5-(difluoromethyl)-3-iodopyridine-2-sulfonyl chloride
CID 118816647
5-cyano-3-(difluoromethyl)-4-fluoropyridine-2-sulfonyl chloride
CID 130076373
4-chloro-5-(difluoromethyl)-6-(trifluoromethyl)pyridin-3-amine
CID 130102768
4-(difluoromethyl)-5-iodo-3-methylpyridine-2-sulfonyl chloride
CID 118852049
[5-amino-4-chloro-3-(difluoromethyl)-2-pyridinyl]methanol
CID 130102835
6-(bromomethyl)-4-chloro-5-(difluoromethyl)pyridin-3-amine
CID 130102704
5-(aminomethyl)-3-(difluoromethyl)-4-(trifluoromethoxy)pyridine-2-sulfonyl chloride
CID 134682315

Frequently Asked Questions

What is the IUPAC name of 5-amino-4-chloro-3-(difluoromethyl)pyridine-2-sulfonyl chloride?
The IUPAC name of 5-amino-4-chloro-3-(difluoromethyl)pyridine-2-sulfonyl chloride (CID 130103084) is 5-amino-4-chloro-3-(difluoromethyl)pyridine-2-sulfonyl chloride.
What is the SMILES notation for 5-amino-4-chloro-3-(difluoromethyl)pyridine-2-sulfonyl chloride?
The canonical SMILES for 5-amino-4-chloro-3-(difluoromethyl)pyridine-2-sulfonyl chloride is Nc1cnc(S(=O)(=O)Cl)c(C(F)F)c1Cl.
What is the InChIKey of 5-amino-4-chloro-3-(difluoromethyl)pyridine-2-sulfonyl chloride?
The InChIKey is TZVIKJABYTUZAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H4Cl2F2N2O2S/c7-4-2(11)1-12-6(15(8,13)14)3(4)5(9)10/h1,5H,11H2.
What are the key properties of 5-amino-4-chloro-3-(difluoromethyl)pyridine-2-sulfonyl chloride?
5-amino-4-chloro-3-(difluoromethyl)pyridine-2-sulfonyl chloride has a molecular weight of 277.08 g/mol, XLogP of 2.18, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-4-chloro-3-(difluoromethyl)pyridine-2-sulfonyl chloride is sourced from PubChem (CID 130103084), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).