dipotassium;2-chloro-6-[3-(2,2-dimethylpropoxy)pyrazol-1-yl]-N-(1,3-dimethylpyrazol-4-yl)sulfonylpyridine-3-carboxamide;6-[3-(2,2-dimethylpropoxy)pyrazol-1-yl]-N-(1,3-dimethylpyrazol-4-yl)sulfonyl-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;hexadecasulfanyl thiohypochlorite;hydride;oxido formate;sulfane;(4S)-2,2,4-trimethylpyrrolidine;hydrochloride

C53H83Cl3K2N14O11S21 — CID 159395492

About dipotassium;2-chloro-6-[3-(2,2-dimethylpropoxy)pyrazol-1-yl]-N-(1,3-dimethylpyrazol-4-yl)sulfonylpyridine-3-carboxamide;6-[3-(2,2-dimethylpropoxy)pyrazol-1-yl]-N-(1,3-dimethylpyrazol-4-yl)sulfonyl-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;hexadecasulfanyl thiohypochlorite;hydride;oxido formate;sulfane;(4S)-2,2,4-trimethylpyrrolidine;hydrochloride

dipotassium;2-chloro-6-[3-(2,2-dimethylpropoxy)pyrazol-1-yl]-N-(1,3-dimethylpyrazol-4-yl)sulfonylpyridine-3-carboxamide;6-[3-(2,2-dimethylpropoxy)pyrazol-1-yl]-N-(1,3-dimethylpyrazol-4-yl)sulfonyl-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;hexadecasulfanyl thiohypochlorite;hydride;oxido formate;sulfane;(4S)-2,2,4-trimethylpyrrolidine;hydrochloride (PubChem CID 159395492) has the molecular formula C53H83Cl3K2N14O11S21 and a molecular weight of 1950.30 g/mol. Its IUPAC name is dipotassium;2-chloro-6-[3-(2,2-dimethylpropoxy)pyrazol-1-yl]-N-(1,3-dimethylpyrazol-4-yl)sulfonylpyridine-3-carboxamide;6-[3-(2,2-dimethylpropoxy)pyrazol-1-yl]-N-(1,3-dimethylpyrazol-4-yl)sulfonyl-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;hexadecasulfanyl thiohypochlorite;hydride;oxido formate;sulfane;(4S)-2,2,4-trimethylpyrrolidine;hydrochloride.

Molecular Properties

• Compound Name: dipotassium;2-chloro-6-[3-(2,2-dimethylpropoxy)pyrazol-1-yl]-N-(1,3-dimethylpyrazol-4-yl)sulfonylpyridine-3-carboxamide;6-[3-(2,2-dimethylpropoxy)pyrazol-1-yl]-N-(1,3-dimethylpyrazol-4-yl)sulfonyl-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;hexadecasulfanyl thiohypochlorite;hydride;oxido formate;sulfane;(4S)-2,2,4-trimethylpyrrolidine;hydrochloride
• PubChem CID: 159395492
• Molecular Formula: C53H83Cl3K2N14O11S21
• Molecular Weight: 1950.30 g/mol
• Exact Mass: 1945.88
• IUPAC Name: dipotassium;2-chloro-6-[3-(2,2-dimethylpropoxy)pyrazol-1-yl]-N-(1,3-dimethylpyrazol-4-yl)sulfonylpyridine-3-carboxamide;6-[3-(2,2-dimethylpropoxy)pyrazol-1-yl]-N-(1,3-dimethylpyrazol-4-yl)sulfonyl-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;hexadecasulfanyl thiohypochlorite;hydride;oxido formate;sulfane;(4S)-2,2,4-trimethylpyrrolidine;hydrochloride
• SMILES: C[C@@H]1CNC(C)(C)C1.Cc1nn(C)cc1S(=O)(=O)NC(=O)c1ccc(-n2ccc(OCC(C)(C)C)n2)nc1Cl.Cc1nn(C)cc1S(=O)(=O)NC(=O)c1ccc(-n2ccc(OCC(C)(C)C)n2)nc1N1C[C@@H](C)CC1(C)C.Cl.O=CO[O-].S.S.SSSSSSSSSSSSSSSSSCl.[H-].[K+].[K+]
• InChI: InChI=1S/C26H37N7O4S.C19H23ClN6O4S.C7H15N.CH2O3.ClHS17.ClH.2K.2H2S.H/c1-17-13-26(6,7)32(14-17)23-19(24(34)30-38(35,36)20-15-31(8)28-18(20)2)9-10-21(27-23)33-12-11-22(29-33)37-16-25(3,4)5;1-12-14(10-25(5)22-12)31(28,29)24-18(27)13-6-7-15(21-17(13)20)26-9-8-16(23-26)30-11-19(2,3)4;1-6-4-7(2,3)8-5-6;2-1-4-3;1-3-5-7-9-11-13-15-17-18-16-14-12-10-8-6-4-2;;;;;;/h9-12,15,17H,13-14,16H2,1-8H3,(H,30,34);6-10H,11H2,1-5H3,(H,24,27);6,8H,4-5H2,1-3H3;1,3H;2H;1H;;;2*1H2;/q;;;;;;2*+1;;;-1/p-1/t17-;;6-;;;;;;;;/m0.0......../s1
• InChIKey: LPGJZGOTTZGRKJ-JDJCGAJHSA-M
• XLogP: 12.02
• TPSA: 306.63 Ų
• H-Bond Donors: 4
• H-Bond Acceptors: 40
• Rotatable Bonds: 29
• Heavy Atoms: 104
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1950.30
LogP ≤ 5	12.02
H-Bond Donors ≤ 5	4
H-Bond Acceptors ≤ 10	40

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'disulphide', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of dipotassium;2-chloro-6-[3-(2,2-dimethylpropoxy)pyrazol-1-yl]-N-(1,3-dimethylpyrazol-4-yl)sulfonylpyridine-3-carboxamide;6-[3-(2,2-dimethylpropoxy)pyrazol-1-yl]-N-(1,3-dimethylpyrazol-4-yl)sulfonyl-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;hexadecasulfanyl thiohypochlorite;hydride;oxido formate;sulfane;(4S)-2,2,4-trimethylpyrrolidine;hydrochloride?

The IUPAC name of dipotassium;2-chloro-6-[3-(2,2-dimethylpropoxy)pyrazol-1-yl]-N-(1,3-dimethylpyrazol-4-yl)sulfonylpyridine-3-carboxamide;6-[3-(2,2-dimethylpropoxy)pyrazol-1-yl]-N-(1,3-dimethylpyrazol-4-yl)sulfonyl-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;hexadecasulfanyl thiohypochlorite;hydride;oxido formate;sulfane;(4S)-2,2,4-trimethylpyrrolidine;hydrochloride (CID 159395492) is dipotassium;2-chloro-6-[3-(2,2-dimethylpropoxy)pyrazol-1-yl]-N-(1,3-dimethylpyrazol-4-yl)sulfonylpyridine-3-carboxamide;6-[3-(2,2-dimethylpropoxy)pyrazol-1-yl]-N-(1,3-dimethylpyrazol-4-yl)sulfonyl-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;hexadecasulfanyl thiohypochlorite;hydride;oxido formate;sulfane;(4S)-2,2,4-trimethylpyrrolidine;hydrochloride.

What is the SMILES notation for dipotassium;2-chloro-6-[3-(2,2-dimethylpropoxy)pyrazol-1-yl]-N-(1,3-dimethylpyrazol-4-yl)sulfonylpyridine-3-carboxamide;6-[3-(2,2-dimethylpropoxy)pyrazol-1-yl]-N-(1,3-dimethylpyrazol-4-yl)sulfonyl-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;hexadecasulfanyl thiohypochlorite;hydride;oxido formate;sulfane;(4S)-2,2,4-trimethylpyrrolidine;hydrochloride?

The canonical SMILES for dipotassium;2-chloro-6-[3-(2,2-dimethylpropoxy)pyrazol-1-yl]-N-(1,3-dimethylpyrazol-4-yl)sulfonylpyridine-3-carboxamide;6-[3-(2,2-dimethylpropoxy)pyrazol-1-yl]-N-(1,3-dimethylpyrazol-4-yl)sulfonyl-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;hexadecasulfanyl thiohypochlorite;hydride;oxido formate;sulfane;(4S)-2,2,4-trimethylpyrrolidine;hydrochloride is C[C@@H]1CNC(C)(C)C1.Cc1nn(C)cc1S(=O)(=O)NC(=O)c1ccc(-n2ccc(OCC(C)(C)C)n2)nc1Cl.Cc1nn(C)cc1S(=O)(=O)NC(=O)c1ccc(-n2ccc(OCC(C)(C)C)n2)nc1N1C[C@@H](C)CC1(C)C.Cl.O=CO[O-].S.S.SSSSSSSSSSSSSSSSSCl.[H-].[K+].[K+].

What is the InChIKey of dipotassium;2-chloro-6-[3-(2,2-dimethylpropoxy)pyrazol-1-yl]-N-(1,3-dimethylpyrazol-4-yl)sulfonylpyridine-3-carboxamide;6-[3-(2,2-dimethylpropoxy)pyrazol-1-yl]-N-(1,3-dimethylpyrazol-4-yl)sulfonyl-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;hexadecasulfanyl thiohypochlorite;hydride;oxido formate;sulfane;(4S)-2,2,4-trimethylpyrrolidine;hydrochloride?

The InChIKey is LPGJZGOTTZGRKJ-JDJCGAJHSA-M. The full InChI is InChI=1S/C26H37N7O4S.C19H23ClN6O4S.C7H15N.CH2O3.ClHS17.ClH.2K.2H2S.H/c1-17-13-26(6,7)32(14-17)23-19(24(34)30-38(35,36)20-15-31(8)28-18(20)2)9-10-21(27-23)33-12-11-22(29-33)37-16-25(3,4)5;1-12-14(10-25(5)22-12)31(28,29)24-18(27)13-6-7-15(21-17(13)20)26-9-8-16(23-26)30-11-19(2,3)4;1-6-4-7(2,3)8-5-6;2-1-4-3;1-3-5-7-9-11-13-15-17-18-16-14-12-10-8-6-4-2;;;;;;/h9-12,15,17H,13-14,16H2,1-8H3,(H,30,34);6-10H,11H2,1-5H3,(H,24,27);6,8H,4-5H2,1-3H3;1,3H;2H;1H;;;2*1H2;/q;;;;;;2*+1;;;-1/p-1/t17-;;6-;;;;;;;;/m0.0......../s1.

What are the key properties of dipotassium;2-chloro-6-[3-(2,2-dimethylpropoxy)pyrazol-1-yl]-N-(1,3-dimethylpyrazol-4-yl)sulfonylpyridine-3-carboxamide;6-[3-(2,2-dimethylpropoxy)pyrazol-1-yl]-N-(1,3-dimethylpyrazol-4-yl)sulfonyl-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;hexadecasulfanyl thiohypochlorite;hydride;oxido formate;sulfane;(4S)-2,2,4-trimethylpyrrolidine;hydrochloride?

dipotassium;2-chloro-6-[3-(2,2-dimethylpropoxy)pyrazol-1-yl]-N-(1,3-dimethylpyrazol-4-yl)sulfonylpyridine-3-carboxamide;6-[3-(2,2-dimethylpropoxy)pyrazol-1-yl]-N-(1,3-dimethylpyrazol-4-yl)sulfonyl-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;hexadecasulfanyl thiohypochlorite;hydride;oxido formate;sulfane;(4S)-2,2,4-trimethylpyrrolidine;hydrochloride has a molecular weight of 1950.30 g/mol, XLogP of 12.02, 29 rotatable bonds, 4 hydrogen bond donors, and 40 hydrogen bond acceptors.

Where does this data come from?

All data for dipotassium;2-chloro-6-[3-(2,2-dimethylpropoxy)pyrazol-1-yl]-N-(1,3-dimethylpyrazol-4-yl)sulfonylpyridine-3-carboxamide;6-[3-(2,2-dimethylpropoxy)pyrazol-1-yl]-N-(1,3-dimethylpyrazol-4-yl)sulfonyl-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;hexadecasulfanyl thiohypochlorite;hydride;oxido formate;sulfane;(4S)-2,2,4-trimethylpyrrolidine;hydrochloride is sourced from PubChem (CID 159395492), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).