N-[2-(3-acetylcyclobutyl)-6-methoxyindazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[2-(3-ethylcyclobutyl)-6-methoxyindazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[2-(3-hydroxycyclobutyl)-6-methoxyindazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[2-[3-(2-hydroxypropan-2-yl)cyclobutyl]indazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[6-methoxy-2-(3-methoxycyclobutyl)indazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;3-[6-methoxy-5-[[6-(trifluoromethyl)pyridine-2-carbonyl]amino]indazol-2-yl]cyclobutane-1-carboxylic acid

C122H114F18N24O17 — CID 165049524

IUPACN-[2-(3-acetylcyclobutyl)-6-methoxyindazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[2-(3-ethylcyclobutyl)-6-methoxyindazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[2-(3-hydroxycyclobutyl)-6-methoxyindazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[2-[3-(2-hydroxypropan-2-yl)cyclobutyl]indazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[6-methoxy-2-(3-methoxycyclobutyl)indazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;3-[6-methoxy-5-[[6-(trifluoromethyl)pyridine-2-carbonyl]amino]indazol-2-yl]cyclobutane-1-carboxylic acid
SMILESCC(C)(O)C1CC(n2cc3cc(NC(=O)c4cccc(C(F)(F)F)n4)ccc3n2)C1.CCC1CC(n2cc3cc(NC(=O)c4cccc(C(F)(F)F)n4)c(OC)cc3n2)C1.COc1cc2nn(C3CC(C(=O)O)C3)cc2cc1NC(=O)c1cccc(C(F)(F)F)n1.COc1cc2nn(C3CC(C(C)=O)C3)cc2cc1NC(=O)c1cccc(C(F)(F)F)n1.COc1cc2nn(C3CC(O)C3)cc2cc1NC(=O)c1cccc(C(F)(F)F)n1.COc1cc2nn(C3CC(OC)C3)cc2cc1NC(=O)c1cccc(C(F)(F)F)n1
InChIInChI=1S/C21H19F3N4O3.2C21H21F3N4O2.C20H17F3N4O4.C20H19F3N4O3.C19H17F3N4O3/c1-11(29)12-6-14(7-12)28-10-13-8-17(18(31-2)9-16(13)27-28)26-20(30)15-4-3-5-19(25-15)21(22,23)24;1-20(2,30)13-9-15(10-13)28-11-12-8-14(6-7-16(12)27-28)25-19(29)17-4-3-5-18(26-17)21(22,23)24;1-3-12-7-14(8-12)28-11-13-9-17(18(30-2)10-16(13)27-28)26-20(29)15-5-4-6-19(25-15)21(22,23)24;1-31-16-8-14-11(9-27(26-14)12-5-10(6-12)19(29)30)7-15(16)25-18(28)13-3-2-4-17(24-13)20(21,22)23;1-29-13-7-12(8-13)27-10-11-6-16(17(30-2)9-15(11)26-27)25-19(28)14-4-3-5-18(24-14)20(21,22)23;1-29-16-8-14-10(9-26(25-14)11-6-12(27)7-11)5-15(16)24-18(28)13-3-2-4-17(23-13)19(20,21)22/h3-5,8-10,12,14H,6-7H2,1-2H3,(H,26,30);3-8,11,13,15,30H,9-10H2,1-2H3,(H,25,29);4-6,9-12,14H,3,7-8H2,1-2H3,(H,26,29);2-4,7-10,12H,5-6H2,1H3,(H,25,28)(H,29,30);3-6,9-10,12-13H,7-8H2,1-2H3,(H,25,28);2-5,8-9,11-12,27H,6-7H2,1H3,(H,24,28)
InChIKeyPLCGAFJZELQKCF-UHFFFAOYSA-N
MW2530.37 g/mol
LogP24.96
Rot. Bonds28

About N-[2-(3-acetylcyclobutyl)-6-methoxyindazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[2-(3-ethylcyclobutyl)-6-methoxyindazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[2-(3-hydroxycyclobutyl)-6-methoxyindazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[2-[3-(2-hydroxypropan-2-yl)cyclobutyl]indazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[6-methoxy-2-(3-methoxycyclobutyl)indazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;3-[6-methoxy-5-[[6-(trifluoromethyl)pyridine-2-carbonyl]amino]indazol-2-yl]cyclobutane-1-carboxylic acid

N-[2-(3-acetylcyclobutyl)-6-methoxyindazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[2-(3-ethylcyclobutyl)-6-methoxyindazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[2-(3-hydroxycyclobutyl)-6-methoxyindazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[2-[3-(2-hydroxypropan-2-yl)cyclobutyl]indazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[6-methoxy-2-(3-methoxycyclobutyl)indazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;3-[6-methoxy-5-[[6-(trifluoromethyl)pyridine-2-carbonyl]amino]indazol-2-yl]cyclobutane-1-carboxylic acid (PubChem CID 165049524) has the molecular formula C122H114F18N24O17 and a molecular weight of 2530.37 g/mol. Its IUPAC name is N-[2-(3-acetylcyclobutyl)-6-methoxyindazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[2-(3-ethylcyclobutyl)-6-methoxyindazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[2-(3-hydroxycyclobutyl)-6-methoxyindazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[2-[3-(2-hydroxypropan-2-yl)cyclobutyl]indazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[6-methoxy-2-(3-methoxycyclobutyl)indazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;3-[6-methoxy-5-[[6-(trifluoromethyl)pyridine-2-carbonyl]amino]indazol-2-yl]cyclobutane-1-carboxylic acid.

Molecular Properties

Compound NameN-[2-(3-acetylcyclobutyl)-6-methoxyindazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[2-(3-ethylcyclobutyl)-6-methoxyindazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[2-(3-hydroxycyclobutyl)-6-methoxyindazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[2-[3-(2-hydroxypropan-2-yl)cyclobutyl]indazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[6-methoxy-2-(3-methoxycyclobutyl)indazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;3-[6-methoxy-5-[[6-(trifluoromethyl)pyridine-2-carbonyl]amino]indazol-2-yl]cyclobutane-1-carboxylic acid
PubChem CID165049524
Molecular FormulaC122H114F18N24O17
Molecular Weight2530.37 g/mol
Exact Mass2528.85
IUPAC NameN-[2-(3-acetylcyclobutyl)-6-methoxyindazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[2-(3-ethylcyclobutyl)-6-methoxyindazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[2-(3-hydroxycyclobutyl)-6-methoxyindazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[2-[3-(2-hydroxypropan-2-yl)cyclobutyl]indazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[6-methoxy-2-(3-methoxycyclobutyl)indazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;3-[6-methoxy-5-[[6-(trifluoromethyl)pyridine-2-carbonyl]amino]indazol-2-yl]cyclobutane-1-carboxylic acid
SMILESCC(C)(O)C1CC(n2cc3cc(NC(=O)c4cccc(C(F)(F)F)n4)ccc3n2)C1.CCC1CC(n2cc3cc(NC(=O)c4cccc(C(F)(F)F)n4)c(OC)cc3n2)C1.COc1cc2nn(C3CC(C(=O)O)C3)cc2cc1NC(=O)c1cccc(C(F)(F)F)n1.COc1cc2nn(C3CC(C(C)=O)C3)cc2cc1NC(=O)c1cccc(C(F)(F)F)n1.COc1cc2nn(C3CC(O)C3)cc2cc1NC(=O)c1cccc(C(F)(F)F)n1.COc1cc2nn(C3CC(OC)C3)cc2cc1NC(=O)c1cccc(C(F)(F)F)n1
InChIInChI=1S/C21H19F3N4O3.2C21H21F3N4O2.C20H17F3N4O4.C20H19F3N4O3.C19H17F3N4O3/c1-11(29)12-6-14(7-12)28-10-13-8-17(18(31-2)9-16(13)27-28)26-20(30)15-4-3-5-19(25-15)21(22,23)24;1-20(2,30)13-9-15(10-13)28-11-12-8-14(6-7-16(12)27-28)25-19(29)17-4-3-5-18(26-17)21(22,23)24;1-3-12-7-14(8-12)28-11-13-9-17(18(30-2)10-16(13)27-28)26-20(29)15-5-4-6-19(25-15)21(22,23)24;1-31-16-8-14-11(9-27(26-14)12-5-10(6-12)19(29)30)7-15(16)25-18(28)13-3-2-4-17(24-13)20(21,22)23;1-29-13-7-12(8-13)27-10-11-6-16(17(30-2)9-15(11)26-27)25-19(28)14-4-3-5-18(24-14)20(21,22)23;1-29-16-8-14-10(9-26(25-14)11-6-12(27)7-11)5-15(16)24-18(28)13-3-2-4-17(23-13)19(20,21)22/h3-5,8-10,12,14H,6-7H2,1-2H3,(H,26,30);3-8,11,13,15,30H,9-10H2,1-2H3,(H,25,29);4-6,9-12,14H,3,7-8H2,1-2H3,(H,26,29);2-4,7-10,12H,5-6H2,1H3,(H,25,28)(H,29,30);3-6,9-10,12-13H,7-8H2,1-2H3,(H,25,28);2-5,8-9,11-12,27H,6-7H2,1H3,(H,24,28)
InChIKeyPLCGAFJZELQKCF-UHFFFAOYSA-N
XLogP24.96
TPSA509.07 Ų
H-Bond Donors9
H-Bond Acceptors34
Rotatable Bonds28
Heavy Atoms181
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002530.37
LogP ≤ 524.96
H-Bond Donors ≤ 59
H-Bond Acceptors ≤ 1034

Analyze N-[2-(3-acetylcyclobutyl)-6-methoxyindazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[2-(3-ethylcyclobutyl)-6-methoxyindazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[2-(3-hydroxycyclobutyl)-6-methoxyindazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[2-[3-(2-hydroxypropan-2-yl)cyclobutyl]indazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[6-methoxy-2-(3-methoxycyclobutyl)indazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;3-[6-methoxy-5-[[6-(trifluoromethyl)pyridine-2-carbonyl]amino]indazol-2-yl]cyclobutane-1-carboxylic acid with MolForge

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Related Compounds

N-[2-[4-[[(2S)-2-[3-[[2-(2,6-dioxopiperidin-3-yl)-1,3-dioxoisoindol-4-yl]amino]propyl]morpholin-4-yl]methyl]cyclohexyl]-6-methoxyindazol-5-yl]-4-[2-[2-[(1R,4R)-4-[[5-[1-(2,6-dioxopiperidin-3-yl)-3-methyl-2-oxobenzimidazol-4-yl]pent-4-ynyl-methylamino]methyl]-3-[(2S,5S)-5-[[4-[[1-(6-hydroxy-2-oxopiperidin-3-yl)-3-methyl-2-oxobenzimidazol-4-yl]methyl]piperidin-1-yl]methyl]-2-[6-(2-hydroxypropan-2-yl)-5-[[6-(trifluoromethyl)pyridine-2-carbonyl]amino]indazol-2-yl]cyclohexyl]cyclohexyl]-5-[[6-(trifluoromethyl)pyridine-2-carbonyl]amino]indazol-6-yl]propan-2-yloxy]-6-(trifluoromethyl)pyridine-2-carboxamide
CID 155448707
6-(1,1-difluoroethyl)-4-[4-[(2R)-2-[[3-[3-[[2-(2,6-dioxopiperidin-3-yl)-1,3-dioxoisoindol-4-yl]amino]cyclobutyl]oxypropyl-methylamino]methyl]-2-methyl-5-[[6-(trifluoromethyl)pyridine-2-carbonyl]amino]-3H-1-benzofuran-6-yl]morpholin-2-yl]-N-[2-[4-[[4-[2-[[2-[(3S)-2,6-dioxopiperidin-3-yl]-1,3-dioxoisoindol-4-yl]amino]ethyl]piperidin-1-yl]methyl]cyclohexyl]-6-methoxyindazol-5-yl]pyridine-2-carboxamide
CID 155448735
N-[2-[4-[[3-[1-(2,6-dioxopiperidin-3-yl)-3-methyl-2-oxobenzimidazol-5-yl]azetidin-1-yl]-[(1R,5S)-3-[2-[1-(2,6-dioxopiperidin-3-yl)-3-methyl-2-oxobenzimidazol-4-yl]ethyl]-8-[[4-[6-(2-hydroxypropan-2-yl)-5-[[6-(trifluoromethyl)pyridine-2-carbonyl]amino]indazol-2-yl]cyclohexyl]methyl]-3,8-diazabicyclo[3.2.1]octan-6-yl]methyl]cyclohexyl]-6-methoxyindazol-5-yl]-6-(2-fluoropropan-2-yl)pyridine-2-carboxamide
CID 155448983
N-[2-[4-[[2-[2-[[2-(2,6-dioxopiperidin-3-yl)-3-hydroxy-1-oxo-3H-isoindol-4-yl]amino]ethyl]-7-azaspiro[3.5]nonan-7-yl]methyl]cyclohexyl]-6-(trifluoromethoxy)indazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide
CID 155449050
N-[2-[(1S,4S)-3-[(2R,5R)-2-[[4-[3-[[2-(2,6-dioxopiperidin-3-yl)-1,3-dioxoisoindol-4-yl]amino]cyclobutyl]oxypiperidin-1-yl]methyl]-5-[5-[[6-(2-fluoropropan-2-yl)pyridine-2-carbonyl]amino]-6-methoxyindazol-2-yl]cyclohexyl]-4-[[4-[3-[[2-(2,6-dioxopiperidin-3-yl)-1,3-dioxoisoindol-4-yl]amino]propoxymethyl]piperidin-1-yl]methyl]cyclohexyl]-6-(2-hydroxypropan-2-yl)indazol-5-yl]-6-methylpyridine-2-carboxamide
CID 155449326
N-[2-[4-[2-[[4-[[1-(2,6-dioxopiperidin-3-yl)-3-methyl-2-oxobenzimidazol-4-yl]methyl]cyclohexyl]-[[4-[6-methoxy-5-[[6-(trifluoromethyl)pyridine-2-carbonyl]amino]indazol-2-yl]cyclohexyl]methyl]amino]-1-[3-[1-(2,6-dioxopiperidin-3-yl)-3-methyl-2-oxobenzimidazol-4-yl]prop-2-ynyl-methylamino]ethyl]cyclohexyl]-6-(2-hydroxypropan-2-yl)indazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide
CID 155449350
N-[2-[4-[[2-[[2-(2,6-dioxopiperidin-3-yl)-1,3-dioxoisoindol-4-yl]amino]-7-azaspiro[3.5]nonan-7-yl]methyl]cyclohexyl]-6-methoxyindazol-5-yl]-4-[2-[2-[3-[[2-[[2-(2,6-dioxopiperidin-3-yl)-3-hydroxy-1-oxo-3H-isoindol-4-yl]amino]spiro[3.5]nonan-7-yl]-methylamino]propyl]-5-[[6-(trifluoromethyl)pyridine-2-carbonyl]amino]indazol-6-yl]-2-hydroxypropyl]-6-(2-fluoropropan-2-yl)pyridine-2-carboxamide
CID 155449549
Tert-butyl 4-(5-amino-6-methoxyindazol-2-yl)piperidine-1-carboxylate;tert-butyl 4-[6-methoxy-5-[[6-(trifluoromethyl)pyridine-2-carbonyl]amino]indazol-2-yl]piperidine-1-carboxylate;6-(trifluoromethyl)pyridine-2-carboxylic acid
CID 157625096
N-[6-methoxy-2-[1-[2-[2-[2-[2-(4-methylidene-2-oxocyclohexyl)-1,3-dioxoisoindol-5-yl]oxyethoxy]ethoxy]ethyl]piperidin-4-yl]indazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[6-methoxy-2-[1-[2-[2-[2-[[2-(4-methylidene-2-oxocyclohexyl)-1-oxo-3H-isoindol-5-yl]oxy]ethoxy]ethoxy]ethyl]piperidin-4-yl]indazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[6-methoxy-2-[1-[2-[2-[2-(6-methylidene-2-oxopiperidin-3-yl)-1,3-dioxoisoindol-5-yl]oxyethoxy]ethyl]piperidin-4-yl]indazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[6-methoxy-2-[1-[2-[2-[[2-(6-methylidene-2-oxopiperidin-3-yl)-1-oxo-3H-isoindol-5-yl]oxy]ethoxy]ethyl]piperidin-4-yl]indazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide
CID 157953299
N-(2-cyclohexyl-6-methoxyindazol-5-yl)-6-(trifluoromethyl)pyridine-2-carboxamide;N-(2-cyclohexyl-6-methoxy-3-methylindazol-5-yl)-6-(trifluoromethyl)pyridine-2-carboxamide;methane;N-[6-methoxy-3-methyl-2-(1-methylpiperidin-4-yl)indazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[6-methoxy-2-(1-methylpiperidin-4-yl)indazol-5-yl]-3-(trifluoromethyl)benzamide;N-[6-methoxy-2-(1-methylpiperidin-4-yl)indazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide
CID 159082886
tert-butyl 5-amino-4-[6-[2-[2-[4-[6-methoxy-5-[[6-(trifluoromethyl)pyridine-2-carbonyl]amino]indazol-2-yl]piperidin-1-yl]ethoxy]ethoxy]-3-oxo-1H-isoindol-2-yl]-5-oxopentanoate;N-[2-[1-[2-[2-[[2-(2,4-dioxocyclohexyl)-1-oxo-3H-isoindol-5-yl]oxy]ethoxy]ethyl]piperidin-4-yl]-6-methoxyindazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;methane
CID 159973836
N-[6-methoxy-2-[1-[2-[2-[2-[3-[2-(6-methylidene-2-oxopiperidin-3-yl)-1,3-dioxoinden-4-yl]propoxy]ethoxy]ethoxy]ethyl]piperidin-4-yl]indazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[6-methoxy-2-[1-[2-[2-[2-[[2-(6-methylidene-2-oxopiperidin-3-yl)-1,3-dioxoisoindol-4-yl]amino]ethoxy]ethoxy]ethyl]piperidin-4-yl]indazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[6-methoxy-2-[1-[[1-[2-[2-(6-methylidene-2-oxopiperidin-3-yl)-1,3-dioxoisoindol-5-yl]oxyethyl]piperidin-4-yl]methyl]piperidin-4-yl]indazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide
CID 160354475

Frequently Asked Questions

What is the IUPAC name of N-[2-(3-acetylcyclobutyl)-6-methoxyindazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[2-(3-ethylcyclobutyl)-6-methoxyindazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[2-(3-hydroxycyclobutyl)-6-methoxyindazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[2-[3-(2-hydroxypropan-2-yl)cyclobutyl]indazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[6-methoxy-2-(3-methoxycyclobutyl)indazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;3-[6-methoxy-5-[[6-(trifluoromethyl)pyridine-2-carbonyl]amino]indazol-2-yl]cyclobutane-1-carboxylic acid?
The IUPAC name of N-[2-(3-acetylcyclobutyl)-6-methoxyindazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[2-(3-ethylcyclobutyl)-6-methoxyindazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[2-(3-hydroxycyclobutyl)-6-methoxyindazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[2-[3-(2-hydroxypropan-2-yl)cyclobutyl]indazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[6-methoxy-2-(3-methoxycyclobutyl)indazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;3-[6-methoxy-5-[[6-(trifluoromethyl)pyridine-2-carbonyl]amino]indazol-2-yl]cyclobutane-1-carboxylic acid (CID 165049524) is N-[2-(3-acetylcyclobutyl)-6-methoxyindazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[2-(3-ethylcyclobutyl)-6-methoxyindazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[2-(3-hydroxycyclobutyl)-6-methoxyindazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[2-[3-(2-hydroxypropan-2-yl)cyclobutyl]indazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[6-methoxy-2-(3-methoxycyclobutyl)indazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;3-[6-methoxy-5-[[6-(trifluoromethyl)pyridine-2-carbonyl]amino]indazol-2-yl]cyclobutane-1-carboxylic acid.
What is the SMILES notation for N-[2-(3-acetylcyclobutyl)-6-methoxyindazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[2-(3-ethylcyclobutyl)-6-methoxyindazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[2-(3-hydroxycyclobutyl)-6-methoxyindazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[2-[3-(2-hydroxypropan-2-yl)cyclobutyl]indazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[6-methoxy-2-(3-methoxycyclobutyl)indazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;3-[6-methoxy-5-[[6-(trifluoromethyl)pyridine-2-carbonyl]amino]indazol-2-yl]cyclobutane-1-carboxylic acid?
The canonical SMILES for N-[2-(3-acetylcyclobutyl)-6-methoxyindazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[2-(3-ethylcyclobutyl)-6-methoxyindazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[2-(3-hydroxycyclobutyl)-6-methoxyindazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[2-[3-(2-hydroxypropan-2-yl)cyclobutyl]indazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[6-methoxy-2-(3-methoxycyclobutyl)indazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;3-[6-methoxy-5-[[6-(trifluoromethyl)pyridine-2-carbonyl]amino]indazol-2-yl]cyclobutane-1-carboxylic acid is CC(C)(O)C1CC(n2cc3cc(NC(=O)c4cccc(C(F)(F)F)n4)ccc3n2)C1.CCC1CC(n2cc3cc(NC(=O)c4cccc(C(F)(F)F)n4)c(OC)cc3n2)C1.COc1cc2nn(C3CC(C(=O)O)C3)cc2cc1NC(=O)c1cccc(C(F)(F)F)n1.COc1cc2nn(C3CC(C(C)=O)C3)cc2cc1NC(=O)c1cccc(C(F)(F)F)n1.COc1cc2nn(C3CC(O)C3)cc2cc1NC(=O)c1cccc(C(F)(F)F)n1.COc1cc2nn(C3CC(OC)C3)cc2cc1NC(=O)c1cccc(C(F)(F)F)n1.
What is the InChIKey of N-[2-(3-acetylcyclobutyl)-6-methoxyindazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[2-(3-ethylcyclobutyl)-6-methoxyindazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[2-(3-hydroxycyclobutyl)-6-methoxyindazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[2-[3-(2-hydroxypropan-2-yl)cyclobutyl]indazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[6-methoxy-2-(3-methoxycyclobutyl)indazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;3-[6-methoxy-5-[[6-(trifluoromethyl)pyridine-2-carbonyl]amino]indazol-2-yl]cyclobutane-1-carboxylic acid?
The InChIKey is PLCGAFJZELQKCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H19F3N4O3.2C21H21F3N4O2.C20H17F3N4O4.C20H19F3N4O3.C19H17F3N4O3/c1-11(29)12-6-14(7-12)28-10-13-8-17(18(31-2)9-16(13)27-28)26-20(30)15-4-3-5-19(25-15)21(22,23)24;1-20(2,30)13-9-15(10-13)28-11-12-8-14(6-7-16(12)27-28)25-19(29)17-4-3-5-18(26-17)21(22,23)24;1-3-12-7-14(8-12)28-11-13-9-17(18(30-2)10-16(13)27-28)26-20(29)15-5-4-6-19(25-15)21(22,23)24;1-31-16-8-14-11(9-27(26-14)12-5-10(6-12)19(29)30)7-15(16)25-18(28)13-3-2-4-17(24-13)20(21,22)23;1-29-13-7-12(8-13)27-10-11-6-16(17(30-2)9-15(11)26-27)25-19(28)14-4-3-5-18(24-14)20(21,22)23;1-29-16-8-14-10(9-26(25-14)11-6-12(27)7-11)5-15(16)24-18(28)13-3-2-4-17(23-13)19(20,21)22/h3-5,8-10,12,14H,6-7H2,1-2H3,(H,26,30);3-8,11,13,15,30H,9-10H2,1-2H3,(H,25,29);4-6,9-12,14H,3,7-8H2,1-2H3,(H,26,29);2-4,7-10,12H,5-6H2,1H3,(H,25,28)(H,29,30);3-6,9-10,12-13H,7-8H2,1-2H3,(H,25,28);2-5,8-9,11-12,27H,6-7H2,1H3,(H,24,28).
What are the key properties of N-[2-(3-acetylcyclobutyl)-6-methoxyindazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[2-(3-ethylcyclobutyl)-6-methoxyindazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[2-(3-hydroxycyclobutyl)-6-methoxyindazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[2-[3-(2-hydroxypropan-2-yl)cyclobutyl]indazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[6-methoxy-2-(3-methoxycyclobutyl)indazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;3-[6-methoxy-5-[[6-(trifluoromethyl)pyridine-2-carbonyl]amino]indazol-2-yl]cyclobutane-1-carboxylic acid?
N-[2-(3-acetylcyclobutyl)-6-methoxyindazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[2-(3-ethylcyclobutyl)-6-methoxyindazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[2-(3-hydroxycyclobutyl)-6-methoxyindazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[2-[3-(2-hydroxypropan-2-yl)cyclobutyl]indazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[6-methoxy-2-(3-methoxycyclobutyl)indazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;3-[6-methoxy-5-[[6-(trifluoromethyl)pyridine-2-carbonyl]amino]indazol-2-yl]cyclobutane-1-carboxylic acid has a molecular weight of 2530.37 g/mol, XLogP of 24.96, 28 rotatable bonds, 9 hydrogen bond donors, and 34 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(3-acetylcyclobutyl)-6-methoxyindazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[2-(3-ethylcyclobutyl)-6-methoxyindazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[2-(3-hydroxycyclobutyl)-6-methoxyindazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[2-[3-(2-hydroxypropan-2-yl)cyclobutyl]indazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;N-[6-methoxy-2-(3-methoxycyclobutyl)indazol-5-yl]-6-(trifluoromethyl)pyridine-2-carboxamide;3-[6-methoxy-5-[[6-(trifluoromethyl)pyridine-2-carbonyl]amino]indazol-2-yl]cyclobutane-1-carboxylic acid is sourced from PubChem (CID 165049524), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).