dipotassium;benzenesulfonamide;N-(benzenesulfonyl)-2-chloro-6-[3-[(1S,2R)-2-methylcyclopropyl]oxypyrazol-1-yl]pyridine-3-carboxamide;N-(benzenesulfonyl)-2-chloro-6-[3-[(1R,2S)-2-methylcyclopropyl]oxypyrazol-1-yl]pyridine-3-carboxamide;N-(benzenesulfonyl)-6-[3-[(1S,2R)-2-methylcyclopropyl]oxypyrazol-1-yl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;N-(benzenesulfonyl)-6-[3-[(1R,2S)-2-methylcyclopropyl]oxypyrazol-1-yl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;tert-butyl 2-chloro-6-[3-[(1S,2R)-2-methylcyclopropyl]oxypyrazol-1-yl]pyridine-3-carboxylate;tert-butyl 2-chloro-6-[3-[(1R,2S)-2-methylcyclopropyl]oxypyrazol-1-yl]pyridine-3-carboxylate;tert-butyl 2,6-dichloropyridine-3-carboxylate;tert-butyl 3-[(1S,2R)-2-methylcyclopropyl]oxypyrazole-1-carboxylate;tert-butyl 3-[(1R,2S)-2-methylcyclopropyl]oxypyrazole-1-carboxylate;2-chloro-6-[3-[(1R,2S)-2-methylcyclopropyl]oxypyrazol-1-yl]pyridine-3-carboxylic acid;2-chloro-6-[3-[(1S,2R)-2-methylcyclopropyl]oxypyrazol-1-yl]pyridine-3-carboxylic acid;deuterio(fluoro)methane;bis(dichloromethane);hydride;5-[(1S,2R)-2-methylcyclopropyl]oxy-1H-pyrazole;5-[(1R,2S)-2-methylcyclopropyl]oxy-1H-pyrazole;oxido formate;sulfane;(4S)-2,2,4-trimethylpyrrolidine

C215H262Cl12FK2N41O43S7 — CID 159236842

IUPACdipotassium;benzenesulfonamide;N-(benzenesulfonyl)-2-chloro-6-[3-[(1S,2R)-2-methylcyclopropyl]oxypyrazol-1-yl]pyridine-3-carboxamide;N-(benzenesulfonyl)-2-chloro-6-[3-[(1R,2S)-2-methylcyclopropyl]oxypyrazol-1-yl]pyridine-3-carboxamide;N-(benzenesulfonyl)-6-[3-[(1S,2R)-2-methylcyclopropyl]oxypyrazol-1-yl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;N-(benzenesulfonyl)-6-[3-[(1R,2S)-2-methylcyclopropyl]oxypyrazol-1-yl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;tert-butyl 2-chloro-6-[3-[(1S,2R)-2-methylcyclopropyl]oxypyrazol-1-yl]pyridine-3-carboxylate;tert-butyl 2-chloro-6-[3-[(1R,2S)-2-methylcyclopropyl]oxypyrazol-1-yl]pyridine-3-carboxylate;tert-butyl 2,6-dichloropyridine-3-carboxylate;tert-butyl 3-[(1S,2R)-2-methylcyclopropyl]oxypyrazole-1-carboxylate;tert-butyl 3-[(1R,2S)-2-methylcyclopropyl]oxypyrazole-1-carboxylate;2-chloro-6-[3-[(1R,2S)-2-methylcyclopropyl]oxypyrazol-1-yl]pyridine-3-carboxylic acid;2-chloro-6-[3-[(1S,2R)-2-methylcyclopropyl]oxypyrazol-1-yl]pyridine-3-carboxylic acid;deuterio(fluoro)methane;bis(dichloromethane);hydride;5-[(1S,2R)-2-methylcyclopropyl]oxy-1H-pyrazole;5-[(1R,2S)-2-methylcyclopropyl]oxy-1H-pyrazole;oxido formate;sulfane;(4S)-2,2,4-trimethylpyrrolidine
SMILESCC(C)(C)OC(=O)c1ccc(Cl)nc1Cl.C[C@@H]1CN(c2nc(-n3ccc(O[C@@H]4C[C@@H]4C)n3)ccc2C(=O)NS(=O)(=O)c2ccccc2)C(C)(C)C1.C[C@@H]1CN(c2nc(-n3ccc(O[C@H]4C[C@H]4C)n3)ccc2C(=O)NS(=O)(=O)c2ccccc2)C(C)(C)C1.C[C@@H]1CNC(C)(C)C1.C[C@@H]1C[C@@H]1Oc1ccn(-c2ccc(C(=O)NS(=O)(=O)c3ccccc3)c(Cl)n2)n1.C[C@@H]1C[C@@H]1Oc1ccn(-c2ccc(C(=O)O)c(Cl)n2)n1.C[C@@H]1C[C@@H]1Oc1ccn(-c2ccc(C(=O)OC(C)(C)C)c(Cl)n2)n1.C[C@@H]1C[C@@H]1Oc1ccn(C(=O)OC(C)(C)C)n1.C[C@@H]1C[C@@H]1Oc1ccn[nH]1.C[C@H]1C[C@H]1Oc1ccn(-c2ccc(C(=O)NS(=O)(=O)c3ccccc3)c(Cl)n2)n1.C[C@H]1C[C@H]1Oc1ccn(-c2ccc(C(=O)O)c(Cl)n2)n1.C[C@H]1C[C@H]1Oc1ccn(-c2ccc(C(=O)OC(C)(C)C)c(Cl)n2)n1.C[C@H]1C[C@H]1Oc1ccn(C(=O)OC(C)(C)C)n1.C[C@H]1C[C@H]1Oc1ccn[nH]1.ClCCl.ClCCl.NS(=O)(=O)c1ccccc1.O=CO[O-].S.S.[2H]CF.[H-].[K+].[K+]
InChIInChI=1S/2C26H31N5O4S.2C19H17ClN4O4S.2C17H20ClN3O3.2C13H12ClN3O3.2C12H18N2O3.C10H11Cl2NO2.2C7H10N2O.C7H15N.C6H7NO2S.2CH2Cl2.CH3F.CH2O3.2K.2H2S.H/c2*1-17-15-26(3,4)30(16-17)24-20(25(32)29-36(33,34)19-8-6-5-7-9-19)10-11-22(27-24)31-13-12-23(28-31)35-21-14-18(21)2;2*1-12-11-15(12)28-17-9-10-24(22-17)16-8-7-14(18(20)21-16)19(25)23-29(26,27)13-5-3-2-4-6-13;2*1-10-9-12(10)23-14-7-8-21(20-14)13-6-5-11(15(18)19-13)16(22)24-17(2,3)4;2*1-7-6-9(7)20-11-4-5-17(16-11)10-3-2-8(13(18)19)12(14)15-10;2*1-8-7-9(8)16-10-5-6-14(13-10)11(15)17-12(2,3)4;1-10(2,3)15-9(14)6-4-5-7(11)13-8(6)12;2*1-5-4-6(5)10-7-2-3-8-9-7;1-6-4-7(2,3)8-5-6;7-10(8,9)6-4-2-1-3-5-6;2*2-1-3;1-2;2-1-4-3;;;;;/h2*5-13,17-18,21H,14-16H2,1-4H3,(H,29,32);2*2-10,12,15H,11H2,1H3,(H,23,25);2*5-8,10,12H,9H2,1-4H3;2*2-5,7,9H,6H2,1H3,(H,18,19);2*5-6,8-9H,7H2,1-4H3;4-5H,1-3H3;2*2-3,5-6H,4H2,1H3,(H,8,9);6,8H,4-5H2,1-3H3;1-5H,(H2,7,8,9);2*1H2;1H3;1,3H;;;2*1H2;/q;;;;;;;;;;;;;;;;;;;2*+1;;;-1/p-1/t17-,18+,21-;17-,18-,21+;2*12-,15+;2*10-,12+;2*7-,9+;2*8-,9+;;2*5-,6+;6-;;;;;;;;;;/m0010101010.100........../s1/i;;;;;;;;;;;;;;;;;1D;;;;;;
InChIKeyNGQZJWJYWCFQOR-ZBDQMACSSA-M
MW4856.81 g/mol
LogP33.97
Rot. Bonds53

About dipotassium;benzenesulfonamide;N-(benzenesulfonyl)-2-chloro-6-[3-[(1S,2R)-2-methylcyclopropyl]oxypyrazol-1-yl]pyridine-3-carboxamide;N-(benzenesulfonyl)-2-chloro-6-[3-[(1R,2S)-2-methylcyclopropyl]oxypyrazol-1-yl]pyridine-3-carboxamide;N-(benzenesulfonyl)-6-[3-[(1S,2R)-2-methylcyclopropyl]oxypyrazol-1-yl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;N-(benzenesulfonyl)-6-[3-[(1R,2S)-2-methylcyclopropyl]oxypyrazol-1-yl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;tert-butyl 2-chloro-6-[3-[(1S,2R)-2-methylcyclopropyl]oxypyrazol-1-yl]pyridine-3-carboxylate;tert-butyl 2-chloro-6-[3-[(1R,2S)-2-methylcyclopropyl]oxypyrazol-1-yl]pyridine-3-carboxylate;tert-butyl 2,6-dichloropyridine-3-carboxylate;tert-butyl 3-[(1S,2R)-2-methylcyclopropyl]oxypyrazole-1-carboxylate;tert-butyl 3-[(1R,2S)-2-methylcyclopropyl]oxypyrazole-1-carboxylate;2-chloro-6-[3-[(1R,2S)-2-methylcyclopropyl]oxypyrazol-1-yl]pyridine-3-carboxylic acid;2-chloro-6-[3-[(1S,2R)-2-methylcyclopropyl]oxypyrazol-1-yl]pyridine-3-carboxylic acid;deuterio(fluoro)methane;bis(dichloromethane);hydride;5-[(1S,2R)-2-methylcyclopropyl]oxy-1H-pyrazole;5-[(1R,2S)-2-methylcyclopropyl]oxy-1H-pyrazole;oxido formate;sulfane;(4S)-2,2,4-trimethylpyrrolidine

dipotassium;benzenesulfonamide;N-(benzenesulfonyl)-2-chloro-6-[3-[(1S,2R)-2-methylcyclopropyl]oxypyrazol-1-yl]pyridine-3-carboxamide;N-(benzenesulfonyl)-2-chloro-6-[3-[(1R,2S)-2-methylcyclopropyl]oxypyrazol-1-yl]pyridine-3-carboxamide;N-(benzenesulfonyl)-6-[3-[(1S,2R)-2-methylcyclopropyl]oxypyrazol-1-yl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;N-(benzenesulfonyl)-6-[3-[(1R,2S)-2-methylcyclopropyl]oxypyrazol-1-yl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;tert-butyl 2-chloro-6-[3-[(1S,2R)-2-methylcyclopropyl]oxypyrazol-1-yl]pyridine-3-carboxylate;tert-butyl 2-chloro-6-[3-[(1R,2S)-2-methylcyclopropyl]oxypyrazol-1-yl]pyridine-3-carboxylate;tert-butyl 2,6-dichloropyridine-3-carboxylate;tert-butyl 3-[(1S,2R)-2-methylcyclopropyl]oxypyrazole-1-carboxylate;tert-butyl 3-[(1R,2S)-2-methylcyclopropyl]oxypyrazole-1-carboxylate;2-chloro-6-[3-[(1R,2S)-2-methylcyclopropyl]oxypyrazol-1-yl]pyridine-3-carboxylic acid;2-chloro-6-[3-[(1S,2R)-2-methylcyclopropyl]oxypyrazol-1-yl]pyridine-3-carboxylic acid;deuterio(fluoro)methane;bis(dichloromethane);hydride;5-[(1S,2R)-2-methylcyclopropyl]oxy-1H-pyrazole;5-[(1R,2S)-2-methylcyclopropyl]oxy-1H-pyrazole;oxido formate;sulfane;(4S)-2,2,4-trimethylpyrrolidine (PubChem CID 159236842) has the molecular formula C215H262Cl12FK2N41O43S7 and a molecular weight of 4856.81 g/mol. Its IUPAC name is dipotassium;benzenesulfonamide;N-(benzenesulfonyl)-2-chloro-6-[3-[(1S,2R)-2-methylcyclopropyl]oxypyrazol-1-yl]pyridine-3-carboxamide;N-(benzenesulfonyl)-2-chloro-6-[3-[(1R,2S)-2-methylcyclopropyl]oxypyrazol-1-yl]pyridine-3-carboxamide;N-(benzenesulfonyl)-6-[3-[(1S,2R)-2-methylcyclopropyl]oxypyrazol-1-yl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;N-(benzenesulfonyl)-6-[3-[(1R,2S)-2-methylcyclopropyl]oxypyrazol-1-yl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;tert-butyl 2-chloro-6-[3-[(1S,2R)-2-methylcyclopropyl]oxypyrazol-1-yl]pyridine-3-carboxylate;tert-butyl 2-chloro-6-[3-[(1R,2S)-2-methylcyclopropyl]oxypyrazol-1-yl]pyridine-3-carboxylate;tert-butyl 2,6-dichloropyridine-3-carboxylate;tert-butyl 3-[(1S,2R)-2-methylcyclopropyl]oxypyrazole-1-carboxylate;tert-butyl 3-[(1R,2S)-2-methylcyclopropyl]oxypyrazole-1-carboxylate;2-chloro-6-[3-[(1R,2S)-2-methylcyclopropyl]oxypyrazol-1-yl]pyridine-3-carboxylic acid;2-chloro-6-[3-[(1S,2R)-2-methylcyclopropyl]oxypyrazol-1-yl]pyridine-3-carboxylic acid;deuterio(fluoro)methane;bis(dichloromethane);hydride;5-[(1S,2R)-2-methylcyclopropyl]oxy-1H-pyrazole;5-[(1R,2S)-2-methylcyclopropyl]oxy-1H-pyrazole;oxido formate;sulfane;(4S)-2,2,4-trimethylpyrrolidine.

Molecular Properties

Compound Namedipotassium;benzenesulfonamide;N-(benzenesulfonyl)-2-chloro-6-[3-[(1S,2R)-2-methylcyclopropyl]oxypyrazol-1-yl]pyridine-3-carboxamide;N-(benzenesulfonyl)-2-chloro-6-[3-[(1R,2S)-2-methylcyclopropyl]oxypyrazol-1-yl]pyridine-3-carboxamide;N-(benzenesulfonyl)-6-[3-[(1S,2R)-2-methylcyclopropyl]oxypyrazol-1-yl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;N-(benzenesulfonyl)-6-[3-[(1R,2S)-2-methylcyclopropyl]oxypyrazol-1-yl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;tert-butyl 2-chloro-6-[3-[(1S,2R)-2-methylcyclopropyl]oxypyrazol-1-yl]pyridine-3-carboxylate;tert-butyl 2-chloro-6-[3-[(1R,2S)-2-methylcyclopropyl]oxypyrazol-1-yl]pyridine-3-carboxylate;tert-butyl 2,6-dichloropyridine-3-carboxylate;tert-butyl 3-[(1S,2R)-2-methylcyclopropyl]oxypyrazole-1-carboxylate;tert-butyl 3-[(1R,2S)-2-methylcyclopropyl]oxypyrazole-1-carboxylate;2-chloro-6-[3-[(1R,2S)-2-methylcyclopropyl]oxypyrazol-1-yl]pyridine-3-carboxylic acid;2-chloro-6-[3-[(1S,2R)-2-methylcyclopropyl]oxypyrazol-1-yl]pyridine-3-carboxylic acid;deuterio(fluoro)methane;bis(dichloromethane);hydride;5-[(1S,2R)-2-methylcyclopropyl]oxy-1H-pyrazole;5-[(1R,2S)-2-methylcyclopropyl]oxy-1H-pyrazole;oxido formate;sulfane;(4S)-2,2,4-trimethylpyrrolidine
PubChem CID159236842
Molecular FormulaC215H262Cl12FK2N41O43S7
Molecular Weight4856.81 g/mol
Exact Mass4847.32
IUPAC Namedipotassium;benzenesulfonamide;N-(benzenesulfonyl)-2-chloro-6-[3-[(1S,2R)-2-methylcyclopropyl]oxypyrazol-1-yl]pyridine-3-carboxamide;N-(benzenesulfonyl)-2-chloro-6-[3-[(1R,2S)-2-methylcyclopropyl]oxypyrazol-1-yl]pyridine-3-carboxamide;N-(benzenesulfonyl)-6-[3-[(1S,2R)-2-methylcyclopropyl]oxypyrazol-1-yl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;N-(benzenesulfonyl)-6-[3-[(1R,2S)-2-methylcyclopropyl]oxypyrazol-1-yl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;tert-butyl 2-chloro-6-[3-[(1S,2R)-2-methylcyclopropyl]oxypyrazol-1-yl]pyridine-3-carboxylate;tert-butyl 2-chloro-6-[3-[(1R,2S)-2-methylcyclopropyl]oxypyrazol-1-yl]pyridine-3-carboxylate;tert-butyl 2,6-dichloropyridine-3-carboxylate;tert-butyl 3-[(1S,2R)-2-methylcyclopropyl]oxypyrazole-1-carboxylate;tert-butyl 3-[(1R,2S)-2-methylcyclopropyl]oxypyrazole-1-carboxylate;2-chloro-6-[3-[(1R,2S)-2-methylcyclopropyl]oxypyrazol-1-yl]pyridine-3-carboxylic acid;2-chloro-6-[3-[(1S,2R)-2-methylcyclopropyl]oxypyrazol-1-yl]pyridine-3-carboxylic acid;deuterio(fluoro)methane;bis(dichloromethane);hydride;5-[(1S,2R)-2-methylcyclopropyl]oxy-1H-pyrazole;5-[(1R,2S)-2-methylcyclopropyl]oxy-1H-pyrazole;oxido formate;sulfane;(4S)-2,2,4-trimethylpyrrolidine
SMILESCC(C)(C)OC(=O)c1ccc(Cl)nc1Cl.C[C@@H]1CN(c2nc(-n3ccc(O[C@@H]4C[C@@H]4C)n3)ccc2C(=O)NS(=O)(=O)c2ccccc2)C(C)(C)C1.C[C@@H]1CN(c2nc(-n3ccc(O[C@H]4C[C@H]4C)n3)ccc2C(=O)NS(=O)(=O)c2ccccc2)C(C)(C)C1.C[C@@H]1CNC(C)(C)C1.C[C@@H]1C[C@@H]1Oc1ccn(-c2ccc(C(=O)NS(=O)(=O)c3ccccc3)c(Cl)n2)n1.C[C@@H]1C[C@@H]1Oc1ccn(-c2ccc(C(=O)O)c(Cl)n2)n1.C[C@@H]1C[C@@H]1Oc1ccn(-c2ccc(C(=O)OC(C)(C)C)c(Cl)n2)n1.C[C@@H]1C[C@@H]1Oc1ccn(C(=O)OC(C)(C)C)n1.C[C@@H]1C[C@@H]1Oc1ccn[nH]1.C[C@H]1C[C@H]1Oc1ccn(-c2ccc(C(=O)NS(=O)(=O)c3ccccc3)c(Cl)n2)n1.C[C@H]1C[C@H]1Oc1ccn(-c2ccc(C(=O)O)c(Cl)n2)n1.C[C@H]1C[C@H]1Oc1ccn(-c2ccc(C(=O)OC(C)(C)C)c(Cl)n2)n1.C[C@H]1C[C@H]1Oc1ccn(C(=O)OC(C)(C)C)n1.C[C@H]1C[C@H]1Oc1ccn[nH]1.ClCCl.ClCCl.NS(=O)(=O)c1ccccc1.O=CO[O-].S.S.[2H]CF.[H-].[K+].[K+]
InChIInChI=1S/2C26H31N5O4S.2C19H17ClN4O4S.2C17H20ClN3O3.2C13H12ClN3O3.2C12H18N2O3.C10H11Cl2NO2.2C7H10N2O.C7H15N.C6H7NO2S.2CH2Cl2.CH3F.CH2O3.2K.2H2S.H/c2*1-17-15-26(3,4)30(16-17)24-20(25(32)29-36(33,34)19-8-6-5-7-9-19)10-11-22(27-24)31-13-12-23(28-31)35-21-14-18(21)2;2*1-12-11-15(12)28-17-9-10-24(22-17)16-8-7-14(18(20)21-16)19(25)23-29(26,27)13-5-3-2-4-6-13;2*1-10-9-12(10)23-14-7-8-21(20-14)13-6-5-11(15(18)19-13)16(22)24-17(2,3)4;2*1-7-6-9(7)20-11-4-5-17(16-11)10-3-2-8(13(18)19)12(14)15-10;2*1-8-7-9(8)16-10-5-6-14(13-10)11(15)17-12(2,3)4;1-10(2,3)15-9(14)6-4-5-7(11)13-8(6)12;2*1-5-4-6(5)10-7-2-3-8-9-7;1-6-4-7(2,3)8-5-6;7-10(8,9)6-4-2-1-3-5-6;2*2-1-3;1-2;2-1-4-3;;;;;/h2*5-13,17-18,21H,14-16H2,1-4H3,(H,29,32);2*2-10,12,15H,11H2,1H3,(H,23,25);2*5-8,10,12H,9H2,1-4H3;2*2-5,7,9H,6H2,1H3,(H,18,19);2*5-6,8-9H,7H2,1-4H3;4-5H,1-3H3;2*2-3,5-6H,4H2,1H3,(H,8,9);6,8H,4-5H2,1-3H3;1-5H,(H2,7,8,9);2*1H2;1H3;1,3H;;;2*1H2;/q;;;;;;;;;;;;;;;;;;;2*+1;;;-1/p-1/t17-,18+,21-;17-,18-,21+;2*12-,15+;2*10-,12+;2*7-,9+;2*8-,9+;;2*5-,6+;6-;;;;;;;;;;/m0010101010.100........../s1/i;;;;;;;;;;;;;;;;;1D;;;;;;
InChIKeyNGQZJWJYWCFQOR-ZBDQMACSSA-M
XLogP33.97
TPSA1049.42 Ų
H-Bond Donors10
H-Bond Acceptors75
Rotatable Bonds53
Heavy Atoms321
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5004856.81
LogP ≤ 533.97
H-Bond Donors ≤ 510
H-Bond Acceptors ≤ 1075

Analyze dipotassium;benzenesulfonamide;N-(benzenesulfonyl)-2-chloro-6-[3-[(1S,2R)-2-methylcyclopropyl]oxypyrazol-1-yl]pyridine-3-carboxamide;N-(benzenesulfonyl)-2-chloro-6-[3-[(1R,2S)-2-methylcyclopropyl]oxypyrazol-1-yl]pyridine-3-carboxamide;N-(benzenesulfonyl)-6-[3-[(1S,2R)-2-methylcyclopropyl]oxypyrazol-1-yl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;N-(benzenesulfonyl)-6-[3-[(1R,2S)-2-methylcyclopropyl]oxypyrazol-1-yl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;tert-butyl 2-chloro-6-[3-[(1S,2R)-2-methylcyclopropyl]oxypyrazol-1-yl]pyridine-3-carboxylate;tert-butyl 2-chloro-6-[3-[(1R,2S)-2-methylcyclopropyl]oxypyrazol-1-yl]pyridine-3-carboxylate;tert-butyl 2,6-dichloropyridine-3-carboxylate;tert-butyl 3-[(1S,2R)-2-methylcyclopropyl]oxypyrazole-1-carboxylate;tert-butyl 3-[(1R,2S)-2-methylcyclopropyl]oxypyrazole-1-carboxylate;2-chloro-6-[3-[(1R,2S)-2-methylcyclopropyl]oxypyrazol-1-yl]pyridine-3-carboxylic acid;2-chloro-6-[3-[(1S,2R)-2-methylcyclopropyl]oxypyrazol-1-yl]pyridine-3-carboxylic acid;deuterio(fluoro)methane;bis(dichloromethane);hydride;5-[(1S,2R)-2-methylcyclopropyl]oxy-1H-pyrazole;5-[(1R,2S)-2-methylcyclopropyl]oxy-1H-pyrazole;oxido formate;sulfane;(4S)-2,2,4-trimethylpyrrolidine with MolForge

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What is the IUPAC name of dipotassium;benzenesulfonamide;N-(benzenesulfonyl)-2-chloro-6-[3-[(1S,2R)-2-methylcyclopropyl]oxypyrazol-1-yl]pyridine-3-carboxamide;N-(benzenesulfonyl)-2-chloro-6-[3-[(1R,2S)-2-methylcyclopropyl]oxypyrazol-1-yl]pyridine-3-carboxamide;N-(benzenesulfonyl)-6-[3-[(1S,2R)-2-methylcyclopropyl]oxypyrazol-1-yl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;N-(benzenesulfonyl)-6-[3-[(1R,2S)-2-methylcyclopropyl]oxypyrazol-1-yl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;tert-butyl 2-chloro-6-[3-[(1S,2R)-2-methylcyclopropyl]oxypyrazol-1-yl]pyridine-3-carboxylate;tert-butyl 2-chloro-6-[3-[(1R,2S)-2-methylcyclopropyl]oxypyrazol-1-yl]pyridine-3-carboxylate;tert-butyl 2,6-dichloropyridine-3-carboxylate;tert-butyl 3-[(1S,2R)-2-methylcyclopropyl]oxypyrazole-1-carboxylate;tert-butyl 3-[(1R,2S)-2-methylcyclopropyl]oxypyrazole-1-carboxylate;2-chloro-6-[3-[(1R,2S)-2-methylcyclopropyl]oxypyrazol-1-yl]pyridine-3-carboxylic acid;2-chloro-6-[3-[(1S,2R)-2-methylcyclopropyl]oxypyrazol-1-yl]pyridine-3-carboxylic acid;deuterio(fluoro)methane;bis(dichloromethane);hydride;5-[(1S,2R)-2-methylcyclopropyl]oxy-1H-pyrazole;5-[(1R,2S)-2-methylcyclopropyl]oxy-1H-pyrazole;oxido formate;sulfane;(4S)-2,2,4-trimethylpyrrolidine?
The IUPAC name of dipotassium;benzenesulfonamide;N-(benzenesulfonyl)-2-chloro-6-[3-[(1S,2R)-2-methylcyclopropyl]oxypyrazol-1-yl]pyridine-3-carboxamide;N-(benzenesulfonyl)-2-chloro-6-[3-[(1R,2S)-2-methylcyclopropyl]oxypyrazol-1-yl]pyridine-3-carboxamide;N-(benzenesulfonyl)-6-[3-[(1S,2R)-2-methylcyclopropyl]oxypyrazol-1-yl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;N-(benzenesulfonyl)-6-[3-[(1R,2S)-2-methylcyclopropyl]oxypyrazol-1-yl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;tert-butyl 2-chloro-6-[3-[(1S,2R)-2-methylcyclopropyl]oxypyrazol-1-yl]pyridine-3-carboxylate;tert-butyl 2-chloro-6-[3-[(1R,2S)-2-methylcyclopropyl]oxypyrazol-1-yl]pyridine-3-carboxylate;tert-butyl 2,6-dichloropyridine-3-carboxylate;tert-butyl 3-[(1S,2R)-2-methylcyclopropyl]oxypyrazole-1-carboxylate;tert-butyl 3-[(1R,2S)-2-methylcyclopropyl]oxypyrazole-1-carboxylate;2-chloro-6-[3-[(1R,2S)-2-methylcyclopropyl]oxypyrazol-1-yl]pyridine-3-carboxylic acid;2-chloro-6-[3-[(1S,2R)-2-methylcyclopropyl]oxypyrazol-1-yl]pyridine-3-carboxylic acid;deuterio(fluoro)methane;bis(dichloromethane);hydride;5-[(1S,2R)-2-methylcyclopropyl]oxy-1H-pyrazole;5-[(1R,2S)-2-methylcyclopropyl]oxy-1H-pyrazole;oxido formate;sulfane;(4S)-2,2,4-trimethylpyrrolidine (CID 159236842) is dipotassium;benzenesulfonamide;N-(benzenesulfonyl)-2-chloro-6-[3-[(1S,2R)-2-methylcyclopropyl]oxypyrazol-1-yl]pyridine-3-carboxamide;N-(benzenesulfonyl)-2-chloro-6-[3-[(1R,2S)-2-methylcyclopropyl]oxypyrazol-1-yl]pyridine-3-carboxamide;N-(benzenesulfonyl)-6-[3-[(1S,2R)-2-methylcyclopropyl]oxypyrazol-1-yl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;N-(benzenesulfonyl)-6-[3-[(1R,2S)-2-methylcyclopropyl]oxypyrazol-1-yl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;tert-butyl 2-chloro-6-[3-[(1S,2R)-2-methylcyclopropyl]oxypyrazol-1-yl]pyridine-3-carboxylate;tert-butyl 2-chloro-6-[3-[(1R,2S)-2-methylcyclopropyl]oxypyrazol-1-yl]pyridine-3-carboxylate;tert-butyl 2,6-dichloropyridine-3-carboxylate;tert-butyl 3-[(1S,2R)-2-methylcyclopropyl]oxypyrazole-1-carboxylate;tert-butyl 3-[(1R,2S)-2-methylcyclopropyl]oxypyrazole-1-carboxylate;2-chloro-6-[3-[(1R,2S)-2-methylcyclopropyl]oxypyrazol-1-yl]pyridine-3-carboxylic acid;2-chloro-6-[3-[(1S,2R)-2-methylcyclopropyl]oxypyrazol-1-yl]pyridine-3-carboxylic acid;deuterio(fluoro)methane;bis(dichloromethane);hydride;5-[(1S,2R)-2-methylcyclopropyl]oxy-1H-pyrazole;5-[(1R,2S)-2-methylcyclopropyl]oxy-1H-pyrazole;oxido formate;sulfane;(4S)-2,2,4-trimethylpyrrolidine.
What is the SMILES notation for dipotassium;benzenesulfonamide;N-(benzenesulfonyl)-2-chloro-6-[3-[(1S,2R)-2-methylcyclopropyl]oxypyrazol-1-yl]pyridine-3-carboxamide;N-(benzenesulfonyl)-2-chloro-6-[3-[(1R,2S)-2-methylcyclopropyl]oxypyrazol-1-yl]pyridine-3-carboxamide;N-(benzenesulfonyl)-6-[3-[(1S,2R)-2-methylcyclopropyl]oxypyrazol-1-yl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;N-(benzenesulfonyl)-6-[3-[(1R,2S)-2-methylcyclopropyl]oxypyrazol-1-yl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;tert-butyl 2-chloro-6-[3-[(1S,2R)-2-methylcyclopropyl]oxypyrazol-1-yl]pyridine-3-carboxylate;tert-butyl 2-chloro-6-[3-[(1R,2S)-2-methylcyclopropyl]oxypyrazol-1-yl]pyridine-3-carboxylate;tert-butyl 2,6-dichloropyridine-3-carboxylate;tert-butyl 3-[(1S,2R)-2-methylcyclopropyl]oxypyrazole-1-carboxylate;tert-butyl 3-[(1R,2S)-2-methylcyclopropyl]oxypyrazole-1-carboxylate;2-chloro-6-[3-[(1R,2S)-2-methylcyclopropyl]oxypyrazol-1-yl]pyridine-3-carboxylic acid;2-chloro-6-[3-[(1S,2R)-2-methylcyclopropyl]oxypyrazol-1-yl]pyridine-3-carboxylic acid;deuterio(fluoro)methane;bis(dichloromethane);hydride;5-[(1S,2R)-2-methylcyclopropyl]oxy-1H-pyrazole;5-[(1R,2S)-2-methylcyclopropyl]oxy-1H-pyrazole;oxido formate;sulfane;(4S)-2,2,4-trimethylpyrrolidine?
The canonical SMILES for dipotassium;benzenesulfonamide;N-(benzenesulfonyl)-2-chloro-6-[3-[(1S,2R)-2-methylcyclopropyl]oxypyrazol-1-yl]pyridine-3-carboxamide;N-(benzenesulfonyl)-2-chloro-6-[3-[(1R,2S)-2-methylcyclopropyl]oxypyrazol-1-yl]pyridine-3-carboxamide;N-(benzenesulfonyl)-6-[3-[(1S,2R)-2-methylcyclopropyl]oxypyrazol-1-yl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;N-(benzenesulfonyl)-6-[3-[(1R,2S)-2-methylcyclopropyl]oxypyrazol-1-yl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;tert-butyl 2-chloro-6-[3-[(1S,2R)-2-methylcyclopropyl]oxypyrazol-1-yl]pyridine-3-carboxylate;tert-butyl 2-chloro-6-[3-[(1R,2S)-2-methylcyclopropyl]oxypyrazol-1-yl]pyridine-3-carboxylate;tert-butyl 2,6-dichloropyridine-3-carboxylate;tert-butyl 3-[(1S,2R)-2-methylcyclopropyl]oxypyrazole-1-carboxylate;tert-butyl 3-[(1R,2S)-2-methylcyclopropyl]oxypyrazole-1-carboxylate;2-chloro-6-[3-[(1R,2S)-2-methylcyclopropyl]oxypyrazol-1-yl]pyridine-3-carboxylic acid;2-chloro-6-[3-[(1S,2R)-2-methylcyclopropyl]oxypyrazol-1-yl]pyridine-3-carboxylic acid;deuterio(fluoro)methane;bis(dichloromethane);hydride;5-[(1S,2R)-2-methylcyclopropyl]oxy-1H-pyrazole;5-[(1R,2S)-2-methylcyclopropyl]oxy-1H-pyrazole;oxido formate;sulfane;(4S)-2,2,4-trimethylpyrrolidine is CC(C)(C)OC(=O)c1ccc(Cl)nc1Cl.C[C@@H]1CN(c2nc(-n3ccc(O[C@@H]4C[C@@H]4C)n3)ccc2C(=O)NS(=O)(=O)c2ccccc2)C(C)(C)C1.C[C@@H]1CN(c2nc(-n3ccc(O[C@H]4C[C@H]4C)n3)ccc2C(=O)NS(=O)(=O)c2ccccc2)C(C)(C)C1.C[C@@H]1CNC(C)(C)C1.C[C@@H]1C[C@@H]1Oc1ccn(-c2ccc(C(=O)NS(=O)(=O)c3ccccc3)c(Cl)n2)n1.C[C@@H]1C[C@@H]1Oc1ccn(-c2ccc(C(=O)O)c(Cl)n2)n1.C[C@@H]1C[C@@H]1Oc1ccn(-c2ccc(C(=O)OC(C)(C)C)c(Cl)n2)n1.C[C@@H]1C[C@@H]1Oc1ccn(C(=O)OC(C)(C)C)n1.C[C@@H]1C[C@@H]1Oc1ccn[nH]1.C[C@H]1C[C@H]1Oc1ccn(-c2ccc(C(=O)NS(=O)(=O)c3ccccc3)c(Cl)n2)n1.C[C@H]1C[C@H]1Oc1ccn(-c2ccc(C(=O)O)c(Cl)n2)n1.C[C@H]1C[C@H]1Oc1ccn(-c2ccc(C(=O)OC(C)(C)C)c(Cl)n2)n1.C[C@H]1C[C@H]1Oc1ccn(C(=O)OC(C)(C)C)n1.C[C@H]1C[C@H]1Oc1ccn[nH]1.ClCCl.ClCCl.NS(=O)(=O)c1ccccc1.O=CO[O-].S.S.[2H]CF.[H-].[K+].[K+].
What is the InChIKey of dipotassium;benzenesulfonamide;N-(benzenesulfonyl)-2-chloro-6-[3-[(1S,2R)-2-methylcyclopropyl]oxypyrazol-1-yl]pyridine-3-carboxamide;N-(benzenesulfonyl)-2-chloro-6-[3-[(1R,2S)-2-methylcyclopropyl]oxypyrazol-1-yl]pyridine-3-carboxamide;N-(benzenesulfonyl)-6-[3-[(1S,2R)-2-methylcyclopropyl]oxypyrazol-1-yl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;N-(benzenesulfonyl)-6-[3-[(1R,2S)-2-methylcyclopropyl]oxypyrazol-1-yl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;tert-butyl 2-chloro-6-[3-[(1S,2R)-2-methylcyclopropyl]oxypyrazol-1-yl]pyridine-3-carboxylate;tert-butyl 2-chloro-6-[3-[(1R,2S)-2-methylcyclopropyl]oxypyrazol-1-yl]pyridine-3-carboxylate;tert-butyl 2,6-dichloropyridine-3-carboxylate;tert-butyl 3-[(1S,2R)-2-methylcyclopropyl]oxypyrazole-1-carboxylate;tert-butyl 3-[(1R,2S)-2-methylcyclopropyl]oxypyrazole-1-carboxylate;2-chloro-6-[3-[(1R,2S)-2-methylcyclopropyl]oxypyrazol-1-yl]pyridine-3-carboxylic acid;2-chloro-6-[3-[(1S,2R)-2-methylcyclopropyl]oxypyrazol-1-yl]pyridine-3-carboxylic acid;deuterio(fluoro)methane;bis(dichloromethane);hydride;5-[(1S,2R)-2-methylcyclopropyl]oxy-1H-pyrazole;5-[(1R,2S)-2-methylcyclopropyl]oxy-1H-pyrazole;oxido formate;sulfane;(4S)-2,2,4-trimethylpyrrolidine?
The InChIKey is NGQZJWJYWCFQOR-ZBDQMACSSA-M. The full InChI is InChI=1S/2C26H31N5O4S.2C19H17ClN4O4S.2C17H20ClN3O3.2C13H12ClN3O3.2C12H18N2O3.C10H11Cl2NO2.2C7H10N2O.C7H15N.C6H7NO2S.2CH2Cl2.CH3F.CH2O3.2K.2H2S.H/c2*1-17-15-26(3,4)30(16-17)24-20(25(32)29-36(33,34)19-8-6-5-7-9-19)10-11-22(27-24)31-13-12-23(28-31)35-21-14-18(21)2;2*1-12-11-15(12)28-17-9-10-24(22-17)16-8-7-14(18(20)21-16)19(25)23-29(26,27)13-5-3-2-4-6-13;2*1-10-9-12(10)23-14-7-8-21(20-14)13-6-5-11(15(18)19-13)16(22)24-17(2,3)4;2*1-7-6-9(7)20-11-4-5-17(16-11)10-3-2-8(13(18)19)12(14)15-10;2*1-8-7-9(8)16-10-5-6-14(13-10)11(15)17-12(2,3)4;1-10(2,3)15-9(14)6-4-5-7(11)13-8(6)12;2*1-5-4-6(5)10-7-2-3-8-9-7;1-6-4-7(2,3)8-5-6;7-10(8,9)6-4-2-1-3-5-6;2*2-1-3;1-2;2-1-4-3;;;;;/h2*5-13,17-18,21H,14-16H2,1-4H3,(H,29,32);2*2-10,12,15H,11H2,1H3,(H,23,25);2*5-8,10,12H,9H2,1-4H3;2*2-5,7,9H,6H2,1H3,(H,18,19);2*5-6,8-9H,7H2,1-4H3;4-5H,1-3H3;2*2-3,5-6H,4H2,1H3,(H,8,9);6,8H,4-5H2,1-3H3;1-5H,(H2,7,8,9);2*1H2;1H3;1,3H;;;2*1H2;/q;;;;;;;;;;;;;;;;;;;2*+1;;;-1/p-1/t17-,18+,21-;17-,18-,21+;2*12-,15+;2*10-,12+;2*7-,9+;2*8-,9+;;2*5-,6+;6-;;;;;;;;;;/m0010101010.100........../s1/i;;;;;;;;;;;;;;;;;1D;;;;;;.
What are the key properties of dipotassium;benzenesulfonamide;N-(benzenesulfonyl)-2-chloro-6-[3-[(1S,2R)-2-methylcyclopropyl]oxypyrazol-1-yl]pyridine-3-carboxamide;N-(benzenesulfonyl)-2-chloro-6-[3-[(1R,2S)-2-methylcyclopropyl]oxypyrazol-1-yl]pyridine-3-carboxamide;N-(benzenesulfonyl)-6-[3-[(1S,2R)-2-methylcyclopropyl]oxypyrazol-1-yl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;N-(benzenesulfonyl)-6-[3-[(1R,2S)-2-methylcyclopropyl]oxypyrazol-1-yl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;tert-butyl 2-chloro-6-[3-[(1S,2R)-2-methylcyclopropyl]oxypyrazol-1-yl]pyridine-3-carboxylate;tert-butyl 2-chloro-6-[3-[(1R,2S)-2-methylcyclopropyl]oxypyrazol-1-yl]pyridine-3-carboxylate;tert-butyl 2,6-dichloropyridine-3-carboxylate;tert-butyl 3-[(1S,2R)-2-methylcyclopropyl]oxypyrazole-1-carboxylate;tert-butyl 3-[(1R,2S)-2-methylcyclopropyl]oxypyrazole-1-carboxylate;2-chloro-6-[3-[(1R,2S)-2-methylcyclopropyl]oxypyrazol-1-yl]pyridine-3-carboxylic acid;2-chloro-6-[3-[(1S,2R)-2-methylcyclopropyl]oxypyrazol-1-yl]pyridine-3-carboxylic acid;deuterio(fluoro)methane;bis(dichloromethane);hydride;5-[(1S,2R)-2-methylcyclopropyl]oxy-1H-pyrazole;5-[(1R,2S)-2-methylcyclopropyl]oxy-1H-pyrazole;oxido formate;sulfane;(4S)-2,2,4-trimethylpyrrolidine?
dipotassium;benzenesulfonamide;N-(benzenesulfonyl)-2-chloro-6-[3-[(1S,2R)-2-methylcyclopropyl]oxypyrazol-1-yl]pyridine-3-carboxamide;N-(benzenesulfonyl)-2-chloro-6-[3-[(1R,2S)-2-methylcyclopropyl]oxypyrazol-1-yl]pyridine-3-carboxamide;N-(benzenesulfonyl)-6-[3-[(1S,2R)-2-methylcyclopropyl]oxypyrazol-1-yl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;N-(benzenesulfonyl)-6-[3-[(1R,2S)-2-methylcyclopropyl]oxypyrazol-1-yl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;tert-butyl 2-chloro-6-[3-[(1S,2R)-2-methylcyclopropyl]oxypyrazol-1-yl]pyridine-3-carboxylate;tert-butyl 2-chloro-6-[3-[(1R,2S)-2-methylcyclopropyl]oxypyrazol-1-yl]pyridine-3-carboxylate;tert-butyl 2,6-dichloropyridine-3-carboxylate;tert-butyl 3-[(1S,2R)-2-methylcyclopropyl]oxypyrazole-1-carboxylate;tert-butyl 3-[(1R,2S)-2-methylcyclopropyl]oxypyrazole-1-carboxylate;2-chloro-6-[3-[(1R,2S)-2-methylcyclopropyl]oxypyrazol-1-yl]pyridine-3-carboxylic acid;2-chloro-6-[3-[(1S,2R)-2-methylcyclopropyl]oxypyrazol-1-yl]pyridine-3-carboxylic acid;deuterio(fluoro)methane;bis(dichloromethane);hydride;5-[(1S,2R)-2-methylcyclopropyl]oxy-1H-pyrazole;5-[(1R,2S)-2-methylcyclopropyl]oxy-1H-pyrazole;oxido formate;sulfane;(4S)-2,2,4-trimethylpyrrolidine has a molecular weight of 4856.81 g/mol, XLogP of 33.97, 53 rotatable bonds, 10 hydrogen bond donors, and 75 hydrogen bond acceptors.
Where does this data come from?
All data for dipotassium;benzenesulfonamide;N-(benzenesulfonyl)-2-chloro-6-[3-[(1S,2R)-2-methylcyclopropyl]oxypyrazol-1-yl]pyridine-3-carboxamide;N-(benzenesulfonyl)-2-chloro-6-[3-[(1R,2S)-2-methylcyclopropyl]oxypyrazol-1-yl]pyridine-3-carboxamide;N-(benzenesulfonyl)-6-[3-[(1S,2R)-2-methylcyclopropyl]oxypyrazol-1-yl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;N-(benzenesulfonyl)-6-[3-[(1R,2S)-2-methylcyclopropyl]oxypyrazol-1-yl]-2-[(4S)-2,2,4-trimethylpyrrolidin-1-yl]pyridine-3-carboxamide;tert-butyl 2-chloro-6-[3-[(1S,2R)-2-methylcyclopropyl]oxypyrazol-1-yl]pyridine-3-carboxylate;tert-butyl 2-chloro-6-[3-[(1R,2S)-2-methylcyclopropyl]oxypyrazol-1-yl]pyridine-3-carboxylate;tert-butyl 2,6-dichloropyridine-3-carboxylate;tert-butyl 3-[(1S,2R)-2-methylcyclopropyl]oxypyrazole-1-carboxylate;tert-butyl 3-[(1R,2S)-2-methylcyclopropyl]oxypyrazole-1-carboxylate;2-chloro-6-[3-[(1R,2S)-2-methylcyclopropyl]oxypyrazol-1-yl]pyridine-3-carboxylic acid;2-chloro-6-[3-[(1S,2R)-2-methylcyclopropyl]oxypyrazol-1-yl]pyridine-3-carboxylic acid;deuterio(fluoro)methane;bis(dichloromethane);hydride;5-[(1S,2R)-2-methylcyclopropyl]oxy-1H-pyrazole;5-[(1R,2S)-2-methylcyclopropyl]oxy-1H-pyrazole;oxido formate;sulfane;(4S)-2,2,4-trimethylpyrrolidine is sourced from PubChem (CID 159236842), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).