1-ethyl-4-(isoquinolin-3-ylmethyl)-N-(6-methylspiro[3.3]heptan-2-yl)indazole-3-carboxamide;1-ethyl-N-(6-methylspiro[3.3]heptan-2-yl)-4-[[3-(trifluoromethyl)phenyl]methyl]indazole-3-carboxamide;1-ethyl-N-(6-methylspiro[3.3]heptan-2-yl)-4-[[4-(trifluoromethyl)phenyl]methyl]indole-3-carboxamide;1-ethyl-N-(6-methylspiro[3.3]heptan-2-yl)-4-[[4-(trifluoromethyl)phenyl]methyl]pyrrolo[2,3-b]pyridine-3-carboxamide;1-(2-fluoroethyl)-N-(6-methylspiro[3.3]heptan-2-yl)-4-[[4-(trifluoromethyl)phenyl]methyl]indole-3-carboxamide;1-(2-methylpropyl)-N-(6-methylspiro[3.3]heptan-2-yl)-4-[[4-(trifluoromethyl)phenyl]methyl]indazole-3-carboxamide;N-(6-methylspiro[3.3]heptan-2-yl)-1-propan-2-yl-4-[[4-(trifluoromethyl)phenyl]methyl]indazole-3-carboxamide;bis(N-(6-methylspiro[3.3]heptan-2-yl)-8-[[4-(trifluoromethyl)phenyl]methyl]imidazo[1,5-a]pyridine-1-carboxamide)

C237H253F25N26O9 — CID 167640587

IUPAC1-ethyl-4-(isoquinolin-3-ylmethyl)-N-(6-methylspiro[3.3]heptan-2-yl)indazole-3-carboxamide;1-ethyl-N-(6-methylspiro[3.3]heptan-2-yl)-4-[[3-(trifluoromethyl)phenyl]methyl]indazole-3-carboxamide;1-ethyl-N-(6-methylspiro[3.3]heptan-2-yl)-4-[[4-(trifluoromethyl)phenyl]methyl]indole-3-carboxamide;1-ethyl-N-(6-methylspiro[3.3]heptan-2-yl)-4-[[4-(trifluoromethyl)phenyl]methyl]pyrrolo[2,3-b]pyridine-3-carboxamide;1-(2-fluoroethyl)-N-(6-methylspiro[3.3]heptan-2-yl)-4-[[4-(trifluoromethyl)phenyl]methyl]indole-3-carboxamide;1-(2-methylpropyl)-N-(6-methylspiro[3.3]heptan-2-yl)-4-[[4-(trifluoromethyl)phenyl]methyl]indazole-3-carboxamide;N-(6-methylspiro[3.3]heptan-2-yl)-1-propan-2-yl-4-[[4-(trifluoromethyl)phenyl]methyl]indazole-3-carboxamide;bis(N-(6-methylspiro[3.3]heptan-2-yl)-8-[[4-(trifluoromethyl)phenyl]methyl]imidazo[1,5-a]pyridine-1-carboxamide)
SMILESCC(C)Cn1nc(C(=O)NC2CC3(CC(C)C3)C2)c2c(Cc3ccc(C(F)(F)F)cc3)cccc21.CC1CC2(C1)CC(NC(=O)c1cn(CCF)c3cccc(Cc4ccc(C(F)(F)F)cc4)c13)C2.CC1CC2(C1)CC(NC(=O)c1ncn3cccc(Cc4ccc(C(F)(F)F)cc4)c13)C2.CC1CC2(C1)CC(NC(=O)c1ncn3cccc(Cc4ccc(C(F)(F)F)cc4)c13)C2.CC1CC2(C1)CC(NC(=O)c1nn(C(C)C)c3cccc(Cc4ccc(C(F)(F)F)cc4)c13)C2.CCn1cc(C(=O)NC2CC3(CC(C)C3)C2)c2c(Cc3ccc(C(F)(F)F)cc3)cccc21.CCn1cc(C(=O)NC2CC3(CC(C)C3)C2)c2c(Cc3ccc(C(F)(F)F)cc3)ccnc21.CCn1nc(C(=O)NC2CC3(CC(C)C3)C2)c2c(Cc3cc4ccccc4cn3)cccc21.CCn1nc(C(=O)NC2CC3(CC(C)C3)C2)c2c(Cc3cccc(C(F)(F)F)c3)cccc21
InChIInChI=1S/C28H32F3N3O.C28H30N4O.C27H28F4N2O.C27H30F3N3O.C27H29F3N2O.2C26H28F3N3O.2C24H24F3N3O/c1-17(2)16-34-23-6-4-5-20(11-19-7-9-21(10-8-19)28(29,30)31)24(23)25(33-34)26(35)32-22-14-27(15-22)12-18(3)13-27;1-3-32-24-10-6-9-20(12-22-11-19-7-4-5-8-21(19)17-29-22)25(24)26(31-32)27(33)30-23-15-28(16-23)13-18(2)14-28;1-17-12-26(13-17)14-21(15-26)32-25(34)22-16-33(10-9-28)23-4-2-3-19(24(22)23)11-18-5-7-20(8-6-18)27(29,30)31;1-16(2)33-22-6-4-5-19(11-18-7-9-20(10-8-18)27(28,29)30)23(22)24(32-33)25(34)31-21-14-26(15-21)12-17(3)13-26;1-3-32-16-22(25(33)31-21-14-26(15-21)12-17(2)13-26)24-19(5-4-6-23(24)32)11-18-7-9-20(10-8-18)27(28,29)30;1-3-32-15-21(24(33)31-20-13-25(14-20)11-16(2)12-25)22-18(8-9-30-23(22)32)10-17-4-6-19(7-5-17)26(27,28)29;1-3-32-21-9-5-7-18(10-17-6-4-8-19(11-17)26(27,28)29)22(21)23(31-32)24(33)30-20-14-25(15-20)12-16(2)13-25;2*1-15-10-23(11-15)12-19(13-23)29-22(31)20-21-17(3-2-8-30(21)14-28-20)9-16-4-6-18(7-5-16)24(25,26)27/h4-10,17-18,22H,11-16H2,1-3H3,(H,32,35);4-11,17-18,23H,3,12-16H2,1-2H3,(H,30,33);2-8,16-17,21H,9-15H2,1H3,(H,32,34);4-10,16-17,21H,11-15H2,1-3H3,(H,31,34);4-10,16-17,21H,3,11-15H2,1-2H3,(H,31,33);4-9,15-16,20H,3,10-14H2,1-2H3,(H,31,33);4-9,11,16,20H,3,10,12-15H2,1-2H3,(H,30,33);2*2-8,14-15,19H,9-13H2,1H3,(H,29,31)
InChIKeyPCOLUOICXXWUNB-UHFFFAOYSA-N
MW4084.75 g/mol
LogP54.21
Rot. Bonds45

About 1-ethyl-4-(isoquinolin-3-ylmethyl)-N-(6-methylspiro[3.3]heptan-2-yl)indazole-3-carboxamide;1-ethyl-N-(6-methylspiro[3.3]heptan-2-yl)-4-[[3-(trifluoromethyl)phenyl]methyl]indazole-3-carboxamide;1-ethyl-N-(6-methylspiro[3.3]heptan-2-yl)-4-[[4-(trifluoromethyl)phenyl]methyl]indole-3-carboxamide;1-ethyl-N-(6-methylspiro[3.3]heptan-2-yl)-4-[[4-(trifluoromethyl)phenyl]methyl]pyrrolo[2,3-b]pyridine-3-carboxamide;1-(2-fluoroethyl)-N-(6-methylspiro[3.3]heptan-2-yl)-4-[[4-(trifluoromethyl)phenyl]methyl]indole-3-carboxamide;1-(2-methylpropyl)-N-(6-methylspiro[3.3]heptan-2-yl)-4-[[4-(trifluoromethyl)phenyl]methyl]indazole-3-carboxamide;N-(6-methylspiro[3.3]heptan-2-yl)-1-propan-2-yl-4-[[4-(trifluoromethyl)phenyl]methyl]indazole-3-carboxamide;bis(N-(6-methylspiro[3.3]heptan-2-yl)-8-[[4-(trifluoromethyl)phenyl]methyl]imidazo[1,5-a]pyridine-1-carboxamide)

1-ethyl-4-(isoquinolin-3-ylmethyl)-N-(6-methylspiro[3.3]heptan-2-yl)indazole-3-carboxamide;1-ethyl-N-(6-methylspiro[3.3]heptan-2-yl)-4-[[3-(trifluoromethyl)phenyl]methyl]indazole-3-carboxamide;1-ethyl-N-(6-methylspiro[3.3]heptan-2-yl)-4-[[4-(trifluoromethyl)phenyl]methyl]indole-3-carboxamide;1-ethyl-N-(6-methylspiro[3.3]heptan-2-yl)-4-[[4-(trifluoromethyl)phenyl]methyl]pyrrolo[2,3-b]pyridine-3-carboxamide;1-(2-fluoroethyl)-N-(6-methylspiro[3.3]heptan-2-yl)-4-[[4-(trifluoromethyl)phenyl]methyl]indole-3-carboxamide;1-(2-methylpropyl)-N-(6-methylspiro[3.3]heptan-2-yl)-4-[[4-(trifluoromethyl)phenyl]methyl]indazole-3-carboxamide;N-(6-methylspiro[3.3]heptan-2-yl)-1-propan-2-yl-4-[[4-(trifluoromethyl)phenyl]methyl]indazole-3-carboxamide;bis(N-(6-methylspiro[3.3]heptan-2-yl)-8-[[4-(trifluoromethyl)phenyl]methyl]imidazo[1,5-a]pyridine-1-carboxamide) (PubChem CID 167640587) has the molecular formula C237H253F25N26O9 and a molecular weight of 4084.75 g/mol. Its IUPAC name is 1-ethyl-4-(isoquinolin-3-ylmethyl)-N-(6-methylspiro[3.3]heptan-2-yl)indazole-3-carboxamide;1-ethyl-N-(6-methylspiro[3.3]heptan-2-yl)-4-[[3-(trifluoromethyl)phenyl]methyl]indazole-3-carboxamide;1-ethyl-N-(6-methylspiro[3.3]heptan-2-yl)-4-[[4-(trifluoromethyl)phenyl]methyl]indole-3-carboxamide;1-ethyl-N-(6-methylspiro[3.3]heptan-2-yl)-4-[[4-(trifluoromethyl)phenyl]methyl]pyrrolo[2,3-b]pyridine-3-carboxamide;1-(2-fluoroethyl)-N-(6-methylspiro[3.3]heptan-2-yl)-4-[[4-(trifluoromethyl)phenyl]methyl]indole-3-carboxamide;1-(2-methylpropyl)-N-(6-methylspiro[3.3]heptan-2-yl)-4-[[4-(trifluoromethyl)phenyl]methyl]indazole-3-carboxamide;N-(6-methylspiro[3.3]heptan-2-yl)-1-propan-2-yl-4-[[4-(trifluoromethyl)phenyl]methyl]indazole-3-carboxamide;bis(N-(6-methylspiro[3.3]heptan-2-yl)-8-[[4-(trifluoromethyl)phenyl]methyl]imidazo[1,5-a]pyridine-1-carboxamide).

Molecular Properties

Compound Name1-ethyl-4-(isoquinolin-3-ylmethyl)-N-(6-methylspiro[3.3]heptan-2-yl)indazole-3-carboxamide;1-ethyl-N-(6-methylspiro[3.3]heptan-2-yl)-4-[[3-(trifluoromethyl)phenyl]methyl]indazole-3-carboxamide;1-ethyl-N-(6-methylspiro[3.3]heptan-2-yl)-4-[[4-(trifluoromethyl)phenyl]methyl]indole-3-carboxamide;1-ethyl-N-(6-methylspiro[3.3]heptan-2-yl)-4-[[4-(trifluoromethyl)phenyl]methyl]pyrrolo[2,3-b]pyridine-3-carboxamide;1-(2-fluoroethyl)-N-(6-methylspiro[3.3]heptan-2-yl)-4-[[4-(trifluoromethyl)phenyl]methyl]indole-3-carboxamide;1-(2-methylpropyl)-N-(6-methylspiro[3.3]heptan-2-yl)-4-[[4-(trifluoromethyl)phenyl]methyl]indazole-3-carboxamide;N-(6-methylspiro[3.3]heptan-2-yl)-1-propan-2-yl-4-[[4-(trifluoromethyl)phenyl]methyl]indazole-3-carboxamide;bis(N-(6-methylspiro[3.3]heptan-2-yl)-8-[[4-(trifluoromethyl)phenyl]methyl]imidazo[1,5-a]pyridine-1-carboxamide)
PubChem CID167640587
Molecular FormulaC237H253F25N26O9
Molecular Weight4084.75 g/mol
Exact Mass4081.97
IUPAC Name1-ethyl-4-(isoquinolin-3-ylmethyl)-N-(6-methylspiro[3.3]heptan-2-yl)indazole-3-carboxamide;1-ethyl-N-(6-methylspiro[3.3]heptan-2-yl)-4-[[3-(trifluoromethyl)phenyl]methyl]indazole-3-carboxamide;1-ethyl-N-(6-methylspiro[3.3]heptan-2-yl)-4-[[4-(trifluoromethyl)phenyl]methyl]indole-3-carboxamide;1-ethyl-N-(6-methylspiro[3.3]heptan-2-yl)-4-[[4-(trifluoromethyl)phenyl]methyl]pyrrolo[2,3-b]pyridine-3-carboxamide;1-(2-fluoroethyl)-N-(6-methylspiro[3.3]heptan-2-yl)-4-[[4-(trifluoromethyl)phenyl]methyl]indole-3-carboxamide;1-(2-methylpropyl)-N-(6-methylspiro[3.3]heptan-2-yl)-4-[[4-(trifluoromethyl)phenyl]methyl]indazole-3-carboxamide;N-(6-methylspiro[3.3]heptan-2-yl)-1-propan-2-yl-4-[[4-(trifluoromethyl)phenyl]methyl]indazole-3-carboxamide;bis(N-(6-methylspiro[3.3]heptan-2-yl)-8-[[4-(trifluoromethyl)phenyl]methyl]imidazo[1,5-a]pyridine-1-carboxamide)
SMILESCC(C)Cn1nc(C(=O)NC2CC3(CC(C)C3)C2)c2c(Cc3ccc(C(F)(F)F)cc3)cccc21.CC1CC2(C1)CC(NC(=O)c1cn(CCF)c3cccc(Cc4ccc(C(F)(F)F)cc4)c13)C2.CC1CC2(C1)CC(NC(=O)c1ncn3cccc(Cc4ccc(C(F)(F)F)cc4)c13)C2.CC1CC2(C1)CC(NC(=O)c1ncn3cccc(Cc4ccc(C(F)(F)F)cc4)c13)C2.CC1CC2(C1)CC(NC(=O)c1nn(C(C)C)c3cccc(Cc4ccc(C(F)(F)F)cc4)c13)C2.CCn1cc(C(=O)NC2CC3(CC(C)C3)C2)c2c(Cc3ccc(C(F)(F)F)cc3)cccc21.CCn1cc(C(=O)NC2CC3(CC(C)C3)C2)c2c(Cc3ccc(C(F)(F)F)cc3)ccnc21.CCn1nc(C(=O)NC2CC3(CC(C)C3)C2)c2c(Cc3cc4ccccc4cn3)cccc21.CCn1nc(C(=O)NC2CC3(CC(C)C3)C2)c2c(Cc3cccc(C(F)(F)F)c3)cccc21
InChIInChI=1S/C28H32F3N3O.C28H30N4O.C27H28F4N2O.C27H30F3N3O.C27H29F3N2O.2C26H28F3N3O.2C24H24F3N3O/c1-17(2)16-34-23-6-4-5-20(11-19-7-9-21(10-8-19)28(29,30)31)24(23)25(33-34)26(35)32-22-14-27(15-22)12-18(3)13-27;1-3-32-24-10-6-9-20(12-22-11-19-7-4-5-8-21(19)17-29-22)25(24)26(31-32)27(33)30-23-15-28(16-23)13-18(2)14-28;1-17-12-26(13-17)14-21(15-26)32-25(34)22-16-33(10-9-28)23-4-2-3-19(24(22)23)11-18-5-7-20(8-6-18)27(29,30)31;1-16(2)33-22-6-4-5-19(11-18-7-9-20(10-8-18)27(28,29)30)23(22)24(32-33)25(34)31-21-14-26(15-21)12-17(3)13-26;1-3-32-16-22(25(33)31-21-14-26(15-21)12-17(2)13-26)24-19(5-4-6-23(24)32)11-18-7-9-20(10-8-18)27(28,29)30;1-3-32-15-21(24(33)31-20-13-25(14-20)11-16(2)12-25)22-18(8-9-30-23(22)32)10-17-4-6-19(7-5-17)26(27,28)29;1-3-32-21-9-5-7-18(10-17-6-4-8-19(11-17)26(27,28)29)22(21)23(31-32)24(33)30-20-14-25(15-20)12-16(2)13-25;2*1-15-10-23(11-15)12-19(13-23)29-22(31)20-21-17(3-2-8-30(21)14-28-20)9-16-4-6-18(7-5-16)24(25,26)27/h4-10,17-18,22H,11-16H2,1-3H3,(H,32,35);4-11,17-18,23H,3,12-16H2,1-2H3,(H,30,33);2-8,16-17,21H,9-15H2,1H3,(H,32,34);4-10,16-17,21H,11-15H2,1-3H3,(H,31,34);4-10,16-17,21H,3,11-15H2,1-2H3,(H,31,33);4-9,15-16,20H,3,10-14H2,1-2H3,(H,31,33);4-9,11,16,20H,3,10,12-15H2,1-2H3,(H,30,33);2*2-8,14-15,19H,9-13H2,1H3,(H,29,31)
InChIKeyPCOLUOICXXWUNB-UHFFFAOYSA-N
XLogP54.21
TPSA408.35 Ų
H-Bond Donors9
H-Bond Acceptors26
Rotatable Bonds45
Heavy Atoms297
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5004084.75
LogP ≤ 554.21
H-Bond Donors ≤ 59
H-Bond Acceptors ≤ 1026

Analyze 1-ethyl-4-(isoquinolin-3-ylmethyl)-N-(6-methylspiro[3.3]heptan-2-yl)indazole-3-carboxamide;1-ethyl-N-(6-methylspiro[3.3]heptan-2-yl)-4-[[3-(trifluoromethyl)phenyl]methyl]indazole-3-carboxamide;1-ethyl-N-(6-methylspiro[3.3]heptan-2-yl)-4-[[4-(trifluoromethyl)phenyl]methyl]indole-3-carboxamide;1-ethyl-N-(6-methylspiro[3.3]heptan-2-yl)-4-[[4-(trifluoromethyl)phenyl]methyl]pyrrolo[2,3-b]pyridine-3-carboxamide;1-(2-fluoroethyl)-N-(6-methylspiro[3.3]heptan-2-yl)-4-[[4-(trifluoromethyl)phenyl]methyl]indole-3-carboxamide;1-(2-methylpropyl)-N-(6-methylspiro[3.3]heptan-2-yl)-4-[[4-(trifluoromethyl)phenyl]methyl]indazole-3-carboxamide;N-(6-methylspiro[3.3]heptan-2-yl)-1-propan-2-yl-4-[[4-(trifluoromethyl)phenyl]methyl]indazole-3-carboxamide;bis(N-(6-methylspiro[3.3]heptan-2-yl)-8-[[4-(trifluoromethyl)phenyl]methyl]imidazo[1,5-a]pyridine-1-carboxamide) with MolForge

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Related Compounds

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5-[7-(difluoromethyl)-3-[1-[5-[7-(difluoromethyl)-3-[1-[5-[7-(difluoromethyl)-6-(1-methylpyrazol-4-yl)-3,4-dihydro-2H-quinolin-1-yl]-3-(methylcarbamoyl)-1H-indol-7-yl]ethyl]-6-(1-methylpyrazol-4-yl)-3,4-dihydro-2H-quinolin-1-yl]-3-(methylcarbamoyl)-1H-pyrrolo[2,3-c]pyridin-7-yl]ethyl]-6-(1-methylpyrazol-4-yl)-3,4-dihydro-2H-quinolin-1-yl]-N,7-dimethyl-1H-pyrrolo[2,3-c]pyridine-3-carboxamide
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CID 138721401

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-4-(isoquinolin-3-ylmethyl)-N-(6-methylspiro[3.3]heptan-2-yl)indazole-3-carboxamide;1-ethyl-N-(6-methylspiro[3.3]heptan-2-yl)-4-[[3-(trifluoromethyl)phenyl]methyl]indazole-3-carboxamide;1-ethyl-N-(6-methylspiro[3.3]heptan-2-yl)-4-[[4-(trifluoromethyl)phenyl]methyl]indole-3-carboxamide;1-ethyl-N-(6-methylspiro[3.3]heptan-2-yl)-4-[[4-(trifluoromethyl)phenyl]methyl]pyrrolo[2,3-b]pyridine-3-carboxamide;1-(2-fluoroethyl)-N-(6-methylspiro[3.3]heptan-2-yl)-4-[[4-(trifluoromethyl)phenyl]methyl]indole-3-carboxamide;1-(2-methylpropyl)-N-(6-methylspiro[3.3]heptan-2-yl)-4-[[4-(trifluoromethyl)phenyl]methyl]indazole-3-carboxamide;N-(6-methylspiro[3.3]heptan-2-yl)-1-propan-2-yl-4-[[4-(trifluoromethyl)phenyl]methyl]indazole-3-carboxamide;bis(N-(6-methylspiro[3.3]heptan-2-yl)-8-[[4-(trifluoromethyl)phenyl]methyl]imidazo[1,5-a]pyridine-1-carboxamide)?
The IUPAC name of 1-ethyl-4-(isoquinolin-3-ylmethyl)-N-(6-methylspiro[3.3]heptan-2-yl)indazole-3-carboxamide;1-ethyl-N-(6-methylspiro[3.3]heptan-2-yl)-4-[[3-(trifluoromethyl)phenyl]methyl]indazole-3-carboxamide;1-ethyl-N-(6-methylspiro[3.3]heptan-2-yl)-4-[[4-(trifluoromethyl)phenyl]methyl]indole-3-carboxamide;1-ethyl-N-(6-methylspiro[3.3]heptan-2-yl)-4-[[4-(trifluoromethyl)phenyl]methyl]pyrrolo[2,3-b]pyridine-3-carboxamide;1-(2-fluoroethyl)-N-(6-methylspiro[3.3]heptan-2-yl)-4-[[4-(trifluoromethyl)phenyl]methyl]indole-3-carboxamide;1-(2-methylpropyl)-N-(6-methylspiro[3.3]heptan-2-yl)-4-[[4-(trifluoromethyl)phenyl]methyl]indazole-3-carboxamide;N-(6-methylspiro[3.3]heptan-2-yl)-1-propan-2-yl-4-[[4-(trifluoromethyl)phenyl]methyl]indazole-3-carboxamide;bis(N-(6-methylspiro[3.3]heptan-2-yl)-8-[[4-(trifluoromethyl)phenyl]methyl]imidazo[1,5-a]pyridine-1-carboxamide) (CID 167640587) is 1-ethyl-4-(isoquinolin-3-ylmethyl)-N-(6-methylspiro[3.3]heptan-2-yl)indazole-3-carboxamide;1-ethyl-N-(6-methylspiro[3.3]heptan-2-yl)-4-[[3-(trifluoromethyl)phenyl]methyl]indazole-3-carboxamide;1-ethyl-N-(6-methylspiro[3.3]heptan-2-yl)-4-[[4-(trifluoromethyl)phenyl]methyl]indole-3-carboxamide;1-ethyl-N-(6-methylspiro[3.3]heptan-2-yl)-4-[[4-(trifluoromethyl)phenyl]methyl]pyrrolo[2,3-b]pyridine-3-carboxamide;1-(2-fluoroethyl)-N-(6-methylspiro[3.3]heptan-2-yl)-4-[[4-(trifluoromethyl)phenyl]methyl]indole-3-carboxamide;1-(2-methylpropyl)-N-(6-methylspiro[3.3]heptan-2-yl)-4-[[4-(trifluoromethyl)phenyl]methyl]indazole-3-carboxamide;N-(6-methylspiro[3.3]heptan-2-yl)-1-propan-2-yl-4-[[4-(trifluoromethyl)phenyl]methyl]indazole-3-carboxamide;bis(N-(6-methylspiro[3.3]heptan-2-yl)-8-[[4-(trifluoromethyl)phenyl]methyl]imidazo[1,5-a]pyridine-1-carboxamide).
What is the SMILES notation for 1-ethyl-4-(isoquinolin-3-ylmethyl)-N-(6-methylspiro[3.3]heptan-2-yl)indazole-3-carboxamide;1-ethyl-N-(6-methylspiro[3.3]heptan-2-yl)-4-[[3-(trifluoromethyl)phenyl]methyl]indazole-3-carboxamide;1-ethyl-N-(6-methylspiro[3.3]heptan-2-yl)-4-[[4-(trifluoromethyl)phenyl]methyl]indole-3-carboxamide;1-ethyl-N-(6-methylspiro[3.3]heptan-2-yl)-4-[[4-(trifluoromethyl)phenyl]methyl]pyrrolo[2,3-b]pyridine-3-carboxamide;1-(2-fluoroethyl)-N-(6-methylspiro[3.3]heptan-2-yl)-4-[[4-(trifluoromethyl)phenyl]methyl]indole-3-carboxamide;1-(2-methylpropyl)-N-(6-methylspiro[3.3]heptan-2-yl)-4-[[4-(trifluoromethyl)phenyl]methyl]indazole-3-carboxamide;N-(6-methylspiro[3.3]heptan-2-yl)-1-propan-2-yl-4-[[4-(trifluoromethyl)phenyl]methyl]indazole-3-carboxamide;bis(N-(6-methylspiro[3.3]heptan-2-yl)-8-[[4-(trifluoromethyl)phenyl]methyl]imidazo[1,5-a]pyridine-1-carboxamide)?
The canonical SMILES for 1-ethyl-4-(isoquinolin-3-ylmethyl)-N-(6-methylspiro[3.3]heptan-2-yl)indazole-3-carboxamide;1-ethyl-N-(6-methylspiro[3.3]heptan-2-yl)-4-[[3-(trifluoromethyl)phenyl]methyl]indazole-3-carboxamide;1-ethyl-N-(6-methylspiro[3.3]heptan-2-yl)-4-[[4-(trifluoromethyl)phenyl]methyl]indole-3-carboxamide;1-ethyl-N-(6-methylspiro[3.3]heptan-2-yl)-4-[[4-(trifluoromethyl)phenyl]methyl]pyrrolo[2,3-b]pyridine-3-carboxamide;1-(2-fluoroethyl)-N-(6-methylspiro[3.3]heptan-2-yl)-4-[[4-(trifluoromethyl)phenyl]methyl]indole-3-carboxamide;1-(2-methylpropyl)-N-(6-methylspiro[3.3]heptan-2-yl)-4-[[4-(trifluoromethyl)phenyl]methyl]indazole-3-carboxamide;N-(6-methylspiro[3.3]heptan-2-yl)-1-propan-2-yl-4-[[4-(trifluoromethyl)phenyl]methyl]indazole-3-carboxamide;bis(N-(6-methylspiro[3.3]heptan-2-yl)-8-[[4-(trifluoromethyl)phenyl]methyl]imidazo[1,5-a]pyridine-1-carboxamide) is CC(C)Cn1nc(C(=O)NC2CC3(CC(C)C3)C2)c2c(Cc3ccc(C(F)(F)F)cc3)cccc21.CC1CC2(C1)CC(NC(=O)c1cn(CCF)c3cccc(Cc4ccc(C(F)(F)F)cc4)c13)C2.CC1CC2(C1)CC(NC(=O)c1ncn3cccc(Cc4ccc(C(F)(F)F)cc4)c13)C2.CC1CC2(C1)CC(NC(=O)c1ncn3cccc(Cc4ccc(C(F)(F)F)cc4)c13)C2.CC1CC2(C1)CC(NC(=O)c1nn(C(C)C)c3cccc(Cc4ccc(C(F)(F)F)cc4)c13)C2.CCn1cc(C(=O)NC2CC3(CC(C)C3)C2)c2c(Cc3ccc(C(F)(F)F)cc3)cccc21.CCn1cc(C(=O)NC2CC3(CC(C)C3)C2)c2c(Cc3ccc(C(F)(F)F)cc3)ccnc21.CCn1nc(C(=O)NC2CC3(CC(C)C3)C2)c2c(Cc3cc4ccccc4cn3)cccc21.CCn1nc(C(=O)NC2CC3(CC(C)C3)C2)c2c(Cc3cccc(C(F)(F)F)c3)cccc21.
What is the InChIKey of 1-ethyl-4-(isoquinolin-3-ylmethyl)-N-(6-methylspiro[3.3]heptan-2-yl)indazole-3-carboxamide;1-ethyl-N-(6-methylspiro[3.3]heptan-2-yl)-4-[[3-(trifluoromethyl)phenyl]methyl]indazole-3-carboxamide;1-ethyl-N-(6-methylspiro[3.3]heptan-2-yl)-4-[[4-(trifluoromethyl)phenyl]methyl]indole-3-carboxamide;1-ethyl-N-(6-methylspiro[3.3]heptan-2-yl)-4-[[4-(trifluoromethyl)phenyl]methyl]pyrrolo[2,3-b]pyridine-3-carboxamide;1-(2-fluoroethyl)-N-(6-methylspiro[3.3]heptan-2-yl)-4-[[4-(trifluoromethyl)phenyl]methyl]indole-3-carboxamide;1-(2-methylpropyl)-N-(6-methylspiro[3.3]heptan-2-yl)-4-[[4-(trifluoromethyl)phenyl]methyl]indazole-3-carboxamide;N-(6-methylspiro[3.3]heptan-2-yl)-1-propan-2-yl-4-[[4-(trifluoromethyl)phenyl]methyl]indazole-3-carboxamide;bis(N-(6-methylspiro[3.3]heptan-2-yl)-8-[[4-(trifluoromethyl)phenyl]methyl]imidazo[1,5-a]pyridine-1-carboxamide)?
The InChIKey is PCOLUOICXXWUNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H32F3N3O.C28H30N4O.C27H28F4N2O.C27H30F3N3O.C27H29F3N2O.2C26H28F3N3O.2C24H24F3N3O/c1-17(2)16-34-23-6-4-5-20(11-19-7-9-21(10-8-19)28(29,30)31)24(23)25(33-34)26(35)32-22-14-27(15-22)12-18(3)13-27;1-3-32-24-10-6-9-20(12-22-11-19-7-4-5-8-21(19)17-29-22)25(24)26(31-32)27(33)30-23-15-28(16-23)13-18(2)14-28;1-17-12-26(13-17)14-21(15-26)32-25(34)22-16-33(10-9-28)23-4-2-3-19(24(22)23)11-18-5-7-20(8-6-18)27(29,30)31;1-16(2)33-22-6-4-5-19(11-18-7-9-20(10-8-18)27(28,29)30)23(22)24(32-33)25(34)31-21-14-26(15-21)12-17(3)13-26;1-3-32-16-22(25(33)31-21-14-26(15-21)12-17(2)13-26)24-19(5-4-6-23(24)32)11-18-7-9-20(10-8-18)27(28,29)30;1-3-32-15-21(24(33)31-20-13-25(14-20)11-16(2)12-25)22-18(8-9-30-23(22)32)10-17-4-6-19(7-5-17)26(27,28)29;1-3-32-21-9-5-7-18(10-17-6-4-8-19(11-17)26(27,28)29)22(21)23(31-32)24(33)30-20-14-25(15-20)12-16(2)13-25;2*1-15-10-23(11-15)12-19(13-23)29-22(31)20-21-17(3-2-8-30(21)14-28-20)9-16-4-6-18(7-5-16)24(25,26)27/h4-10,17-18,22H,11-16H2,1-3H3,(H,32,35);4-11,17-18,23H,3,12-16H2,1-2H3,(H,30,33);2-8,16-17,21H,9-15H2,1H3,(H,32,34);4-10,16-17,21H,11-15H2,1-3H3,(H,31,34);4-10,16-17,21H,3,11-15H2,1-2H3,(H,31,33);4-9,15-16,20H,3,10-14H2,1-2H3,(H,31,33);4-9,11,16,20H,3,10,12-15H2,1-2H3,(H,30,33);2*2-8,14-15,19H,9-13H2,1H3,(H,29,31).
What are the key properties of 1-ethyl-4-(isoquinolin-3-ylmethyl)-N-(6-methylspiro[3.3]heptan-2-yl)indazole-3-carboxamide;1-ethyl-N-(6-methylspiro[3.3]heptan-2-yl)-4-[[3-(trifluoromethyl)phenyl]methyl]indazole-3-carboxamide;1-ethyl-N-(6-methylspiro[3.3]heptan-2-yl)-4-[[4-(trifluoromethyl)phenyl]methyl]indole-3-carboxamide;1-ethyl-N-(6-methylspiro[3.3]heptan-2-yl)-4-[[4-(trifluoromethyl)phenyl]methyl]pyrrolo[2,3-b]pyridine-3-carboxamide;1-(2-fluoroethyl)-N-(6-methylspiro[3.3]heptan-2-yl)-4-[[4-(trifluoromethyl)phenyl]methyl]indole-3-carboxamide;1-(2-methylpropyl)-N-(6-methylspiro[3.3]heptan-2-yl)-4-[[4-(trifluoromethyl)phenyl]methyl]indazole-3-carboxamide;N-(6-methylspiro[3.3]heptan-2-yl)-1-propan-2-yl-4-[[4-(trifluoromethyl)phenyl]methyl]indazole-3-carboxamide;bis(N-(6-methylspiro[3.3]heptan-2-yl)-8-[[4-(trifluoromethyl)phenyl]methyl]imidazo[1,5-a]pyridine-1-carboxamide)?
1-ethyl-4-(isoquinolin-3-ylmethyl)-N-(6-methylspiro[3.3]heptan-2-yl)indazole-3-carboxamide;1-ethyl-N-(6-methylspiro[3.3]heptan-2-yl)-4-[[3-(trifluoromethyl)phenyl]methyl]indazole-3-carboxamide;1-ethyl-N-(6-methylspiro[3.3]heptan-2-yl)-4-[[4-(trifluoromethyl)phenyl]methyl]indole-3-carboxamide;1-ethyl-N-(6-methylspiro[3.3]heptan-2-yl)-4-[[4-(trifluoromethyl)phenyl]methyl]pyrrolo[2,3-b]pyridine-3-carboxamide;1-(2-fluoroethyl)-N-(6-methylspiro[3.3]heptan-2-yl)-4-[[4-(trifluoromethyl)phenyl]methyl]indole-3-carboxamide;1-(2-methylpropyl)-N-(6-methylspiro[3.3]heptan-2-yl)-4-[[4-(trifluoromethyl)phenyl]methyl]indazole-3-carboxamide;N-(6-methylspiro[3.3]heptan-2-yl)-1-propan-2-yl-4-[[4-(trifluoromethyl)phenyl]methyl]indazole-3-carboxamide;bis(N-(6-methylspiro[3.3]heptan-2-yl)-8-[[4-(trifluoromethyl)phenyl]methyl]imidazo[1,5-a]pyridine-1-carboxamide) has a molecular weight of 4084.75 g/mol, XLogP of 54.21, 45 rotatable bonds, 9 hydrogen bond donors, and 26 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-4-(isoquinolin-3-ylmethyl)-N-(6-methylspiro[3.3]heptan-2-yl)indazole-3-carboxamide;1-ethyl-N-(6-methylspiro[3.3]heptan-2-yl)-4-[[3-(trifluoromethyl)phenyl]methyl]indazole-3-carboxamide;1-ethyl-N-(6-methylspiro[3.3]heptan-2-yl)-4-[[4-(trifluoromethyl)phenyl]methyl]indole-3-carboxamide;1-ethyl-N-(6-methylspiro[3.3]heptan-2-yl)-4-[[4-(trifluoromethyl)phenyl]methyl]pyrrolo[2,3-b]pyridine-3-carboxamide;1-(2-fluoroethyl)-N-(6-methylspiro[3.3]heptan-2-yl)-4-[[4-(trifluoromethyl)phenyl]methyl]indole-3-carboxamide;1-(2-methylpropyl)-N-(6-methylspiro[3.3]heptan-2-yl)-4-[[4-(trifluoromethyl)phenyl]methyl]indazole-3-carboxamide;N-(6-methylspiro[3.3]heptan-2-yl)-1-propan-2-yl-4-[[4-(trifluoromethyl)phenyl]methyl]indazole-3-carboxamide;bis(N-(6-methylspiro[3.3]heptan-2-yl)-8-[[4-(trifluoromethyl)phenyl]methyl]imidazo[1,5-a]pyridine-1-carboxamide) is sourced from PubChem (CID 167640587), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).