6-amino-N-[6-(2-chlorophenyl)-5-(trifluoromethyl)-2-pyridinyl]pyridine-2-sulfonamide

C17H12ClF3N4O2S — CID 134306571

IUPAC6-amino-N-[6-(2-chlorophenyl)-5-(trifluoromethyl)-2-pyridinyl]pyridine-2-sulfonamide
SMILESNc1cccc(S(=O)(=O)Nc2ccc(C(F)(F)F)c(-c3ccccc3Cl)n2)n1
InChIInChI=1S/C17H12ClF3N4O2S/c18-12-5-2-1-4-10(12)16-11(17(19,20)21)8-9-14(24-16)25-28(26,27)15-7-3-6-13(22)23-15/h1-9H,(H2,22,23)(H,24,25)
InChIKeyPAIAKNUERDAQLN-UHFFFAOYSA-N
MW428.82 g/mol
LogP4.20
Rot. Bonds4

About 6-amino-N-[6-(2-chlorophenyl)-5-(trifluoromethyl)-2-pyridinyl]pyridine-2-sulfonamide

6-amino-N-[6-(2-chlorophenyl)-5-(trifluoromethyl)-2-pyridinyl]pyridine-2-sulfonamide (PubChem CID 134306571) has the molecular formula C17H12ClF3N4O2S and a molecular weight of 428.82 g/mol. Its IUPAC name is 6-amino-N-[6-(2-chlorophenyl)-5-(trifluoromethyl)-2-pyridinyl]pyridine-2-sulfonamide.

Molecular Properties

Compound Name6-amino-N-[6-(2-chlorophenyl)-5-(trifluoromethyl)-2-pyridinyl]pyridine-2-sulfonamide
PubChem CID134306571
Molecular FormulaC17H12ClF3N4O2S
Molecular Weight428.82 g/mol
Exact Mass428.03
IUPAC Name6-amino-N-[6-(2-chlorophenyl)-5-(trifluoromethyl)-2-pyridinyl]pyridine-2-sulfonamide
SMILESNc1cccc(S(=O)(=O)Nc2ccc(C(F)(F)F)c(-c3ccccc3Cl)n2)n1
InChIInChI=1S/C17H12ClF3N4O2S/c18-12-5-2-1-4-10(12)16-11(17(19,20)21)8-9-14(24-16)25-28(26,27)15-7-3-6-13(22)23-15/h1-9H,(H2,22,23)(H,24,25)
InChIKeyPAIAKNUERDAQLN-UHFFFAOYSA-N
XLogP4.20
TPSA97.97 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500428.82
LogP ≤ 54.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 6-amino-N-[6-(2-chlorophenyl)-5-(trifluoromethyl)-2-pyridinyl]pyridine-2-sulfonamide with MolForge

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Related Compounds

N-(Pyridin-2-yl) arylsulfonamide, 11
CID 44143306
N-(Pyridin-2-yl) arylsulfonamide, 20
CID 44143309
N-[5-(2-chlorophenyl)-2-pyridinyl]-2,5-difluorobenzenesulfonamide
CID 11531026
3-chloro-N-[6-(3-fluorophenyl)-2-pyridinyl]-2-methylbenzenesulfonamide
CID 11545309
N-[5-(2,4-dichlorophenyl)-6-methyl-2-pyridinyl]-2,4-difluorobenzenesulfonamide
CID 11553722
3-chloro-N-[6-(2-fluorophenyl)-2-pyridinyl]-2-methylbenzenesulfonamide
CID 11559857
N-[5-(2,4-dichlorophenyl)-6-methyl-2-pyridinyl]-4-fluorobenzenesulfonamide
CID 11575135
N-[5-(2-chlorophenyl)pyridin-2-yl]-3-(trifluoromethyl)benzenesulfonamide
CID 11575179
3-chloro-N-[6-(2,4-difluorophenyl)-2-pyridinyl]-2-methylbenzenesulfonamide
CID 11581993
N-[5-(2-chlorophenyl)-6-methylpyridin-2-yl]-3-(trifluoromethyl)benzenesulfonamide
CID 11582694
N-[5-(2-chlorophenyl)-6-methyl-2-pyridinyl]-4-fluorobenzenesulfonamide
CID 11595965
3-chloro-N-[6-(4-fluoro-2-methylphenyl)-2-pyridinyl]-2-methylbenzenesulfonamide
CID 11603518

Frequently Asked Questions

What is the IUPAC name of 6-amino-N-[6-(2-chlorophenyl)-5-(trifluoromethyl)-2-pyridinyl]pyridine-2-sulfonamide?
The IUPAC name of 6-amino-N-[6-(2-chlorophenyl)-5-(trifluoromethyl)-2-pyridinyl]pyridine-2-sulfonamide (CID 134306571) is 6-amino-N-[6-(2-chlorophenyl)-5-(trifluoromethyl)-2-pyridinyl]pyridine-2-sulfonamide.
What is the SMILES notation for 6-amino-N-[6-(2-chlorophenyl)-5-(trifluoromethyl)-2-pyridinyl]pyridine-2-sulfonamide?
The canonical SMILES for 6-amino-N-[6-(2-chlorophenyl)-5-(trifluoromethyl)-2-pyridinyl]pyridine-2-sulfonamide is Nc1cccc(S(=O)(=O)Nc2ccc(C(F)(F)F)c(-c3ccccc3Cl)n2)n1.
What is the InChIKey of 6-amino-N-[6-(2-chlorophenyl)-5-(trifluoromethyl)-2-pyridinyl]pyridine-2-sulfonamide?
The InChIKey is PAIAKNUERDAQLN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H12ClF3N4O2S/c18-12-5-2-1-4-10(12)16-11(17(19,20)21)8-9-14(24-16)25-28(26,27)15-7-3-6-13(22)23-15/h1-9H,(H2,22,23)(H,24,25).
What are the key properties of 6-amino-N-[6-(2-chlorophenyl)-5-(trifluoromethyl)-2-pyridinyl]pyridine-2-sulfonamide?
6-amino-N-[6-(2-chlorophenyl)-5-(trifluoromethyl)-2-pyridinyl]pyridine-2-sulfonamide has a molecular weight of 428.82 g/mol, XLogP of 4.20, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-N-[6-(2-chlorophenyl)-5-(trifluoromethyl)-2-pyridinyl]pyridine-2-sulfonamide is sourced from PubChem (CID 134306571), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).