(6aR,9R)-4,7-dimethyl-N-pentan-3-yl-5-(trifluoromethyl)-6,6a,8,9,10,10a-hexahydroindolo[4,3-fg]quinoline-9-carboxamide;(6aR,9R)-5,7-dimethyl-N-pentan-3-yl-4-(trifluoromethyl)-6,6a,8,9,10,10a-hexahydroindolo[4,3-fg]quinoline-9-carboxamide;(6aR,9R)-4,7-dimethyl-N-pentan-3-yl-5-(trifluoromethyl)-6,6a,8,9-tetrahydroindolo[4,3-fg]quinoline-9-carboxamide;(6aR,9R)-5,7-dimethyl-N-pentan-3-yl-4-(trifluoromethyl)-6,6a,8,9-tetrahydroindolo[4,3-fg]quinoline-9-carboxamide;(6aR,9R)-N-[(2S)-1-hydroxybutan-2-yl]-4,5,7-trimethyl-6,6a,8,9-tetrahydroindolo[4,3-fg]quinoline-9-carboxamide;(6aR,9R)-7-methyl-N-pentan-3-yl-4,5-bis(trifluoromethyl)-6,6a,8,9,10,10a-hexahydroindolo[4,3-fg]quinoline-9-carboxamide;(6aR,9R)-7-methyl-N-pentan-3-yl-4,5-bis(trifluoromethyl)-6,6a,8,9-tetrahydroindolo[4,3-fg]quinoline-9-carboxamide;(6aR,9R)-4,5,7-trimethyl-N-pentan-3-yl-6,6a,8,9,10,10a-hexahydroindolo[4,3-fg]quinoline-9-carboxamide

C183H230F24N24O9 — CID 161412711

IUPAC(6aR,9R)-4,7-dimethyl-N-pentan-3-yl-5-(trifluoromethyl)-6,6a,8,9,10,10a-hexahydroindolo[4,3-fg]quinoline-9-carboxamide;(6aR,9R)-5,7-dimethyl-N-pentan-3-yl-4-(trifluoromethyl)-6,6a,8,9,10,10a-hexahydroindolo[4,3-fg]quinoline-9-carboxamide;(6aR,9R)-4,7-dimethyl-N-pentan-3-yl-5-(trifluoromethyl)-6,6a,8,9-tetrahydroindolo[4,3-fg]quinoline-9-carboxamide;(6aR,9R)-5,7-dimethyl-N-pentan-3-yl-4-(trifluoromethyl)-6,6a,8,9-tetrahydroindolo[4,3-fg]quinoline-9-carboxamide;(6aR,9R)-N-[(2S)-1-hydroxybutan-2-yl]-4,5,7-trimethyl-6,6a,8,9-tetrahydroindolo[4,3-fg]quinoline-9-carboxamide;(6aR,9R)-7-methyl-N-pentan-3-yl-4,5-bis(trifluoromethyl)-6,6a,8,9,10,10a-hexahydroindolo[4,3-fg]quinoline-9-carboxamide;(6aR,9R)-7-methyl-N-pentan-3-yl-4,5-bis(trifluoromethyl)-6,6a,8,9-tetrahydroindolo[4,3-fg]quinoline-9-carboxamide;(6aR,9R)-4,5,7-trimethyl-N-pentan-3-yl-6,6a,8,9,10,10a-hexahydroindolo[4,3-fg]quinoline-9-carboxamide
SMILESCCC(CC)NC(=O)[C@@H]1C=C2c3cccc4c3c(c(C(F)(F)F)n4C(F)(F)F)C[C@H]2N(C)C1.CCC(CC)NC(=O)[C@@H]1C=C2c3cccc4c3c(c(C(F)(F)F)n4C)C[C@H]2N(C)C1.CCC(CC)NC(=O)[C@@H]1C=C2c3cccc4c3c(c(C)n4C(F)(F)F)C[C@H]2N(C)C1.CCC(CC)NC(=O)[C@@H]1CC2c3cccc4c3c(c(C(F)(F)F)n4C(F)(F)F)C[C@H]2N(C)C1.CCC(CC)NC(=O)[C@@H]1CC2c3cccc4c3c(c(C(F)(F)F)n4C)C[C@H]2N(C)C1.CCC(CC)NC(=O)[C@@H]1CC2c3cccc4c3c(c(C)n4C(F)(F)F)C[C@H]2N(C)C1.CCC(CC)NC(=O)[C@@H]1CC2c3cccc4c3c(c(C)n4C)C[C@H]2N(C)C1.CC[C@@H](CO)NC(=O)[C@@H]1C=C2c3cccc4c3c(c(C)n4C)C[C@H]2N(C)C1
InChIInChI=1S/C23H27F6N3O.C23H25F6N3O.C23H30F3N3O.C23H28F3N3O.C23H30F3N3O.C23H28F3N3O.C23H33N3O.C22H29N3O2/c2*1-4-13(5-2)30-21(33)12-9-15-14-7-6-8-17-19(14)16(10-18(15)31(3)11-12)20(22(24,25)26)32(17)23(27,28)29;2*1-5-14(6-2)27-22(30)13-10-16-15-8-7-9-18-20(15)17(11-19(16)28(3)12-13)21(29(18)4)23(24,25)26;2*1-5-15(6-2)27-22(30)14-10-18-16-8-7-9-19-21(16)17(11-20(18)28(4)12-14)13(3)29(19)23(24,25)26;1-6-16(7-2)24-23(27)15-11-19-17-9-8-10-20-22(17)18(14(3)26(20)5)12-21(19)25(4)13-15;1-5-15(12-26)23-22(27)14-9-18-16-7-6-8-19-21(16)17(13(2)25(19)4)10-20(18)24(3)11-14/h6-8,12-13,15,18H,4-5,9-11H2,1-3H3,(H,30,33);6-9,12-13,18H,4-5,10-11H2,1-3H3,(H,30,33);7-9,13-14,16,19H,5-6,10-12H2,1-4H3,(H,27,30);7-10,13-14,19H,5-6,11-12H2,1-4H3,(H,27,30);7-9,14-15,18,20H,5-6,10-12H2,1-4H3,(H,27,30);7-10,14-15,20H,5-6,11-12H2,1-4H3,(H,27,30);8-10,15-16,19,21H,6-7,11-13H2,1-5H3,(H,24,27);6-9,14-15,20,26H,5,10-12H2,1-4H3,(H,23,27)/t12-,15?,18-;12-,18-;13-,16?,19-;13-,19-;14-,18?,20-;14-,20-;15-,19?,21-;14-,15+,20-/m11111111/s1
InChIKeyVVRLZXGDOMJAAH-SDJXYSSGSA-N
MW3365.96 g/mol
LogP34.83
Rot. Bonds32

About (6aR,9R)-4,7-dimethyl-N-pentan-3-yl-5-(trifluoromethyl)-6,6a,8,9,10,10a-hexahydroindolo[4,3-fg]quinoline-9-carboxamide;(6aR,9R)-5,7-dimethyl-N-pentan-3-yl-4-(trifluoromethyl)-6,6a,8,9,10,10a-hexahydroindolo[4,3-fg]quinoline-9-carboxamide;(6aR,9R)-4,7-dimethyl-N-pentan-3-yl-5-(trifluoromethyl)-6,6a,8,9-tetrahydroindolo[4,3-fg]quinoline-9-carboxamide;(6aR,9R)-5,7-dimethyl-N-pentan-3-yl-4-(trifluoromethyl)-6,6a,8,9-tetrahydroindolo[4,3-fg]quinoline-9-carboxamide;(6aR,9R)-N-[(2S)-1-hydroxybutan-2-yl]-4,5,7-trimethyl-6,6a,8,9-tetrahydroindolo[4,3-fg]quinoline-9-carboxamide;(6aR,9R)-7-methyl-N-pentan-3-yl-4,5-bis(trifluoromethyl)-6,6a,8,9,10,10a-hexahydroindolo[4,3-fg]quinoline-9-carboxamide;(6aR,9R)-7-methyl-N-pentan-3-yl-4,5-bis(trifluoromethyl)-6,6a,8,9-tetrahydroindolo[4,3-fg]quinoline-9-carboxamide;(6aR,9R)-4,5,7-trimethyl-N-pentan-3-yl-6,6a,8,9,10,10a-hexahydroindolo[4,3-fg]quinoline-9-carboxamide

(6aR,9R)-4,7-dimethyl-N-pentan-3-yl-5-(trifluoromethyl)-6,6a,8,9,10,10a-hexahydroindolo[4,3-fg]quinoline-9-carboxamide;(6aR,9R)-5,7-dimethyl-N-pentan-3-yl-4-(trifluoromethyl)-6,6a,8,9,10,10a-hexahydroindolo[4,3-fg]quinoline-9-carboxamide;(6aR,9R)-4,7-dimethyl-N-pentan-3-yl-5-(trifluoromethyl)-6,6a,8,9-tetrahydroindolo[4,3-fg]quinoline-9-carboxamide;(6aR,9R)-5,7-dimethyl-N-pentan-3-yl-4-(trifluoromethyl)-6,6a,8,9-tetrahydroindolo[4,3-fg]quinoline-9-carboxamide;(6aR,9R)-N-[(2S)-1-hydroxybutan-2-yl]-4,5,7-trimethyl-6,6a,8,9-tetrahydroindolo[4,3-fg]quinoline-9-carboxamide;(6aR,9R)-7-methyl-N-pentan-3-yl-4,5-bis(trifluoromethyl)-6,6a,8,9,10,10a-hexahydroindolo[4,3-fg]quinoline-9-carboxamide;(6aR,9R)-7-methyl-N-pentan-3-yl-4,5-bis(trifluoromethyl)-6,6a,8,9-tetrahydroindolo[4,3-fg]quinoline-9-carboxamide;(6aR,9R)-4,5,7-trimethyl-N-pentan-3-yl-6,6a,8,9,10,10a-hexahydroindolo[4,3-fg]quinoline-9-carboxamide (PubChem CID 161412711) has the molecular formula C183H230F24N24O9 and a molecular weight of 3365.96 g/mol. Its IUPAC name is (6aR,9R)-4,7-dimethyl-N-pentan-3-yl-5-(trifluoromethyl)-6,6a,8,9,10,10a-hexahydroindolo[4,3-fg]quinoline-9-carboxamide;(6aR,9R)-5,7-dimethyl-N-pentan-3-yl-4-(trifluoromethyl)-6,6a,8,9,10,10a-hexahydroindolo[4,3-fg]quinoline-9-carboxamide;(6aR,9R)-4,7-dimethyl-N-pentan-3-yl-5-(trifluoromethyl)-6,6a,8,9-tetrahydroindolo[4,3-fg]quinoline-9-carboxamide;(6aR,9R)-5,7-dimethyl-N-pentan-3-yl-4-(trifluoromethyl)-6,6a,8,9-tetrahydroindolo[4,3-fg]quinoline-9-carboxamide;(6aR,9R)-N-[(2S)-1-hydroxybutan-2-yl]-4,5,7-trimethyl-6,6a,8,9-tetrahydroindolo[4,3-fg]quinoline-9-carboxamide;(6aR,9R)-7-methyl-N-pentan-3-yl-4,5-bis(trifluoromethyl)-6,6a,8,9,10,10a-hexahydroindolo[4,3-fg]quinoline-9-carboxamide;(6aR,9R)-7-methyl-N-pentan-3-yl-4,5-bis(trifluoromethyl)-6,6a,8,9-tetrahydroindolo[4,3-fg]quinoline-9-carboxamide;(6aR,9R)-4,5,7-trimethyl-N-pentan-3-yl-6,6a,8,9,10,10a-hexahydroindolo[4,3-fg]quinoline-9-carboxamide.

Molecular Properties

Compound Name(6aR,9R)-4,7-dimethyl-N-pentan-3-yl-5-(trifluoromethyl)-6,6a,8,9,10,10a-hexahydroindolo[4,3-fg]quinoline-9-carboxamide;(6aR,9R)-5,7-dimethyl-N-pentan-3-yl-4-(trifluoromethyl)-6,6a,8,9,10,10a-hexahydroindolo[4,3-fg]quinoline-9-carboxamide;(6aR,9R)-4,7-dimethyl-N-pentan-3-yl-5-(trifluoromethyl)-6,6a,8,9-tetrahydroindolo[4,3-fg]quinoline-9-carboxamide;(6aR,9R)-5,7-dimethyl-N-pentan-3-yl-4-(trifluoromethyl)-6,6a,8,9-tetrahydroindolo[4,3-fg]quinoline-9-carboxamide;(6aR,9R)-N-[(2S)-1-hydroxybutan-2-yl]-4,5,7-trimethyl-6,6a,8,9-tetrahydroindolo[4,3-fg]quinoline-9-carboxamide;(6aR,9R)-7-methyl-N-pentan-3-yl-4,5-bis(trifluoromethyl)-6,6a,8,9,10,10a-hexahydroindolo[4,3-fg]quinoline-9-carboxamide;(6aR,9R)-7-methyl-N-pentan-3-yl-4,5-bis(trifluoromethyl)-6,6a,8,9-tetrahydroindolo[4,3-fg]quinoline-9-carboxamide;(6aR,9R)-4,5,7-trimethyl-N-pentan-3-yl-6,6a,8,9,10,10a-hexahydroindolo[4,3-fg]quinoline-9-carboxamide
PubChem CID161412711
Molecular FormulaC183H230F24N24O9
Molecular Weight3365.96 g/mol
Exact Mass3363.79
IUPAC Name(6aR,9R)-4,7-dimethyl-N-pentan-3-yl-5-(trifluoromethyl)-6,6a,8,9,10,10a-hexahydroindolo[4,3-fg]quinoline-9-carboxamide;(6aR,9R)-5,7-dimethyl-N-pentan-3-yl-4-(trifluoromethyl)-6,6a,8,9,10,10a-hexahydroindolo[4,3-fg]quinoline-9-carboxamide;(6aR,9R)-4,7-dimethyl-N-pentan-3-yl-5-(trifluoromethyl)-6,6a,8,9-tetrahydroindolo[4,3-fg]quinoline-9-carboxamide;(6aR,9R)-5,7-dimethyl-N-pentan-3-yl-4-(trifluoromethyl)-6,6a,8,9-tetrahydroindolo[4,3-fg]quinoline-9-carboxamide;(6aR,9R)-N-[(2S)-1-hydroxybutan-2-yl]-4,5,7-trimethyl-6,6a,8,9-tetrahydroindolo[4,3-fg]quinoline-9-carboxamide;(6aR,9R)-7-methyl-N-pentan-3-yl-4,5-bis(trifluoromethyl)-6,6a,8,9,10,10a-hexahydroindolo[4,3-fg]quinoline-9-carboxamide;(6aR,9R)-7-methyl-N-pentan-3-yl-4,5-bis(trifluoromethyl)-6,6a,8,9-tetrahydroindolo[4,3-fg]quinoline-9-carboxamide;(6aR,9R)-4,5,7-trimethyl-N-pentan-3-yl-6,6a,8,9,10,10a-hexahydroindolo[4,3-fg]quinoline-9-carboxamide
SMILESCCC(CC)NC(=O)[C@@H]1C=C2c3cccc4c3c(c(C(F)(F)F)n4C(F)(F)F)C[C@H]2N(C)C1.CCC(CC)NC(=O)[C@@H]1C=C2c3cccc4c3c(c(C(F)(F)F)n4C)C[C@H]2N(C)C1.CCC(CC)NC(=O)[C@@H]1C=C2c3cccc4c3c(c(C)n4C(F)(F)F)C[C@H]2N(C)C1.CCC(CC)NC(=O)[C@@H]1CC2c3cccc4c3c(c(C(F)(F)F)n4C(F)(F)F)C[C@H]2N(C)C1.CCC(CC)NC(=O)[C@@H]1CC2c3cccc4c3c(c(C(F)(F)F)n4C)C[C@H]2N(C)C1.CCC(CC)NC(=O)[C@@H]1CC2c3cccc4c3c(c(C)n4C(F)(F)F)C[C@H]2N(C)C1.CCC(CC)NC(=O)[C@@H]1CC2c3cccc4c3c(c(C)n4C)C[C@H]2N(C)C1.CC[C@@H](CO)NC(=O)[C@@H]1C=C2c3cccc4c3c(c(C)n4C)C[C@H]2N(C)C1
InChIInChI=1S/C23H27F6N3O.C23H25F6N3O.C23H30F3N3O.C23H28F3N3O.C23H30F3N3O.C23H28F3N3O.C23H33N3O.C22H29N3O2/c2*1-4-13(5-2)30-21(33)12-9-15-14-7-6-8-17-19(14)16(10-18(15)31(3)11-12)20(22(24,25)26)32(17)23(27,28)29;2*1-5-14(6-2)27-22(30)13-10-16-15-8-7-9-18-20(15)17(11-19(16)28(3)12-13)21(29(18)4)23(24,25)26;2*1-5-15(6-2)27-22(30)14-10-18-16-8-7-9-19-21(16)17(11-20(18)28(4)12-14)13(3)29(19)23(24,25)26;1-6-16(7-2)24-23(27)15-11-19-17-9-8-10-20-22(17)18(14(3)26(20)5)12-21(19)25(4)13-15;1-5-15(12-26)23-22(27)14-9-18-16-7-6-8-19-21(16)17(13(2)25(19)4)10-20(18)24(3)11-14/h6-8,12-13,15,18H,4-5,9-11H2,1-3H3,(H,30,33);6-9,12-13,18H,4-5,10-11H2,1-3H3,(H,30,33);7-9,13-14,16,19H,5-6,10-12H2,1-4H3,(H,27,30);7-10,13-14,19H,5-6,11-12H2,1-4H3,(H,27,30);7-9,14-15,18,20H,5-6,10-12H2,1-4H3,(H,27,30);7-10,14-15,20H,5-6,11-12H2,1-4H3,(H,27,30);8-10,15-16,19,21H,6-7,11-13H2,1-5H3,(H,24,27);6-9,14-15,20,26H,5,10-12H2,1-4H3,(H,23,27)/t12-,15?,18-;12-,18-;13-,16?,19-;13-,19-;14-,18?,20-;14-,20-;15-,19?,21-;14-,15+,20-/m11111111/s1
InChIKeyVVRLZXGDOMJAAH-SDJXYSSGSA-N
XLogP34.83
TPSA318.39 Ų
H-Bond Donors9
H-Bond Acceptors25
Rotatable Bonds32
Heavy Atoms240
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003365.96
LogP ≤ 534.83
H-Bond Donors ≤ 59
H-Bond Acceptors ≤ 1025

Analyze (6aR,9R)-4,7-dimethyl-N-pentan-3-yl-5-(trifluoromethyl)-6,6a,8,9,10,10a-hexahydroindolo[4,3-fg]quinoline-9-carboxamide;(6aR,9R)-5,7-dimethyl-N-pentan-3-yl-4-(trifluoromethyl)-6,6a,8,9,10,10a-hexahydroindolo[4,3-fg]quinoline-9-carboxamide;(6aR,9R)-4,7-dimethyl-N-pentan-3-yl-5-(trifluoromethyl)-6,6a,8,9-tetrahydroindolo[4,3-fg]quinoline-9-carboxamide;(6aR,9R)-5,7-dimethyl-N-pentan-3-yl-4-(trifluoromethyl)-6,6a,8,9-tetrahydroindolo[4,3-fg]quinoline-9-carboxamide;(6aR,9R)-N-[(2S)-1-hydroxybutan-2-yl]-4,5,7-trimethyl-6,6a,8,9-tetrahydroindolo[4,3-fg]quinoline-9-carboxamide;(6aR,9R)-7-methyl-N-pentan-3-yl-4,5-bis(trifluoromethyl)-6,6a,8,9,10,10a-hexahydroindolo[4,3-fg]quinoline-9-carboxamide;(6aR,9R)-7-methyl-N-pentan-3-yl-4,5-bis(trifluoromethyl)-6,6a,8,9-tetrahydroindolo[4,3-fg]quinoline-9-carboxamide;(6aR,9R)-4,5,7-trimethyl-N-pentan-3-yl-6,6a,8,9,10,10a-hexahydroindolo[4,3-fg]quinoline-9-carboxamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of (6aR,9R)-4,7-dimethyl-N-pentan-3-yl-5-(trifluoromethyl)-6,6a,8,9,10,10a-hexahydroindolo[4,3-fg]quinoline-9-carboxamide;(6aR,9R)-5,7-dimethyl-N-pentan-3-yl-4-(trifluoromethyl)-6,6a,8,9,10,10a-hexahydroindolo[4,3-fg]quinoline-9-carboxamide;(6aR,9R)-4,7-dimethyl-N-pentan-3-yl-5-(trifluoromethyl)-6,6a,8,9-tetrahydroindolo[4,3-fg]quinoline-9-carboxamide;(6aR,9R)-5,7-dimethyl-N-pentan-3-yl-4-(trifluoromethyl)-6,6a,8,9-tetrahydroindolo[4,3-fg]quinoline-9-carboxamide;(6aR,9R)-N-[(2S)-1-hydroxybutan-2-yl]-4,5,7-trimethyl-6,6a,8,9-tetrahydroindolo[4,3-fg]quinoline-9-carboxamide;(6aR,9R)-7-methyl-N-pentan-3-yl-4,5-bis(trifluoromethyl)-6,6a,8,9,10,10a-hexahydroindolo[4,3-fg]quinoline-9-carboxamide;(6aR,9R)-7-methyl-N-pentan-3-yl-4,5-bis(trifluoromethyl)-6,6a,8,9-tetrahydroindolo[4,3-fg]quinoline-9-carboxamide;(6aR,9R)-4,5,7-trimethyl-N-pentan-3-yl-6,6a,8,9,10,10a-hexahydroindolo[4,3-fg]quinoline-9-carboxamide?
The IUPAC name of (6aR,9R)-4,7-dimethyl-N-pentan-3-yl-5-(trifluoromethyl)-6,6a,8,9,10,10a-hexahydroindolo[4,3-fg]quinoline-9-carboxamide;(6aR,9R)-5,7-dimethyl-N-pentan-3-yl-4-(trifluoromethyl)-6,6a,8,9,10,10a-hexahydroindolo[4,3-fg]quinoline-9-carboxamide;(6aR,9R)-4,7-dimethyl-N-pentan-3-yl-5-(trifluoromethyl)-6,6a,8,9-tetrahydroindolo[4,3-fg]quinoline-9-carboxamide;(6aR,9R)-5,7-dimethyl-N-pentan-3-yl-4-(trifluoromethyl)-6,6a,8,9-tetrahydroindolo[4,3-fg]quinoline-9-carboxamide;(6aR,9R)-N-[(2S)-1-hydroxybutan-2-yl]-4,5,7-trimethyl-6,6a,8,9-tetrahydroindolo[4,3-fg]quinoline-9-carboxamide;(6aR,9R)-7-methyl-N-pentan-3-yl-4,5-bis(trifluoromethyl)-6,6a,8,9,10,10a-hexahydroindolo[4,3-fg]quinoline-9-carboxamide;(6aR,9R)-7-methyl-N-pentan-3-yl-4,5-bis(trifluoromethyl)-6,6a,8,9-tetrahydroindolo[4,3-fg]quinoline-9-carboxamide;(6aR,9R)-4,5,7-trimethyl-N-pentan-3-yl-6,6a,8,9,10,10a-hexahydroindolo[4,3-fg]quinoline-9-carboxamide (CID 161412711) is (6aR,9R)-4,7-dimethyl-N-pentan-3-yl-5-(trifluoromethyl)-6,6a,8,9,10,10a-hexahydroindolo[4,3-fg]quinoline-9-carboxamide;(6aR,9R)-5,7-dimethyl-N-pentan-3-yl-4-(trifluoromethyl)-6,6a,8,9,10,10a-hexahydroindolo[4,3-fg]quinoline-9-carboxamide;(6aR,9R)-4,7-dimethyl-N-pentan-3-yl-5-(trifluoromethyl)-6,6a,8,9-tetrahydroindolo[4,3-fg]quinoline-9-carboxamide;(6aR,9R)-5,7-dimethyl-N-pentan-3-yl-4-(trifluoromethyl)-6,6a,8,9-tetrahydroindolo[4,3-fg]quinoline-9-carboxamide;(6aR,9R)-N-[(2S)-1-hydroxybutan-2-yl]-4,5,7-trimethyl-6,6a,8,9-tetrahydroindolo[4,3-fg]quinoline-9-carboxamide;(6aR,9R)-7-methyl-N-pentan-3-yl-4,5-bis(trifluoromethyl)-6,6a,8,9,10,10a-hexahydroindolo[4,3-fg]quinoline-9-carboxamide;(6aR,9R)-7-methyl-N-pentan-3-yl-4,5-bis(trifluoromethyl)-6,6a,8,9-tetrahydroindolo[4,3-fg]quinoline-9-carboxamide;(6aR,9R)-4,5,7-trimethyl-N-pentan-3-yl-6,6a,8,9,10,10a-hexahydroindolo[4,3-fg]quinoline-9-carboxamide.
What is the SMILES notation for (6aR,9R)-4,7-dimethyl-N-pentan-3-yl-5-(trifluoromethyl)-6,6a,8,9,10,10a-hexahydroindolo[4,3-fg]quinoline-9-carboxamide;(6aR,9R)-5,7-dimethyl-N-pentan-3-yl-4-(trifluoromethyl)-6,6a,8,9,10,10a-hexahydroindolo[4,3-fg]quinoline-9-carboxamide;(6aR,9R)-4,7-dimethyl-N-pentan-3-yl-5-(trifluoromethyl)-6,6a,8,9-tetrahydroindolo[4,3-fg]quinoline-9-carboxamide;(6aR,9R)-5,7-dimethyl-N-pentan-3-yl-4-(trifluoromethyl)-6,6a,8,9-tetrahydroindolo[4,3-fg]quinoline-9-carboxamide;(6aR,9R)-N-[(2S)-1-hydroxybutan-2-yl]-4,5,7-trimethyl-6,6a,8,9-tetrahydroindolo[4,3-fg]quinoline-9-carboxamide;(6aR,9R)-7-methyl-N-pentan-3-yl-4,5-bis(trifluoromethyl)-6,6a,8,9,10,10a-hexahydroindolo[4,3-fg]quinoline-9-carboxamide;(6aR,9R)-7-methyl-N-pentan-3-yl-4,5-bis(trifluoromethyl)-6,6a,8,9-tetrahydroindolo[4,3-fg]quinoline-9-carboxamide;(6aR,9R)-4,5,7-trimethyl-N-pentan-3-yl-6,6a,8,9,10,10a-hexahydroindolo[4,3-fg]quinoline-9-carboxamide?
The canonical SMILES for (6aR,9R)-4,7-dimethyl-N-pentan-3-yl-5-(trifluoromethyl)-6,6a,8,9,10,10a-hexahydroindolo[4,3-fg]quinoline-9-carboxamide;(6aR,9R)-5,7-dimethyl-N-pentan-3-yl-4-(trifluoromethyl)-6,6a,8,9,10,10a-hexahydroindolo[4,3-fg]quinoline-9-carboxamide;(6aR,9R)-4,7-dimethyl-N-pentan-3-yl-5-(trifluoromethyl)-6,6a,8,9-tetrahydroindolo[4,3-fg]quinoline-9-carboxamide;(6aR,9R)-5,7-dimethyl-N-pentan-3-yl-4-(trifluoromethyl)-6,6a,8,9-tetrahydroindolo[4,3-fg]quinoline-9-carboxamide;(6aR,9R)-N-[(2S)-1-hydroxybutan-2-yl]-4,5,7-trimethyl-6,6a,8,9-tetrahydroindolo[4,3-fg]quinoline-9-carboxamide;(6aR,9R)-7-methyl-N-pentan-3-yl-4,5-bis(trifluoromethyl)-6,6a,8,9,10,10a-hexahydroindolo[4,3-fg]quinoline-9-carboxamide;(6aR,9R)-7-methyl-N-pentan-3-yl-4,5-bis(trifluoromethyl)-6,6a,8,9-tetrahydroindolo[4,3-fg]quinoline-9-carboxamide;(6aR,9R)-4,5,7-trimethyl-N-pentan-3-yl-6,6a,8,9,10,10a-hexahydroindolo[4,3-fg]quinoline-9-carboxamide is CCC(CC)NC(=O)[C@@H]1C=C2c3cccc4c3c(c(C(F)(F)F)n4C(F)(F)F)C[C@H]2N(C)C1.CCC(CC)NC(=O)[C@@H]1C=C2c3cccc4c3c(c(C(F)(F)F)n4C)C[C@H]2N(C)C1.CCC(CC)NC(=O)[C@@H]1C=C2c3cccc4c3c(c(C)n4C(F)(F)F)C[C@H]2N(C)C1.CCC(CC)NC(=O)[C@@H]1CC2c3cccc4c3c(c(C(F)(F)F)n4C(F)(F)F)C[C@H]2N(C)C1.CCC(CC)NC(=O)[C@@H]1CC2c3cccc4c3c(c(C(F)(F)F)n4C)C[C@H]2N(C)C1.CCC(CC)NC(=O)[C@@H]1CC2c3cccc4c3c(c(C)n4C(F)(F)F)C[C@H]2N(C)C1.CCC(CC)NC(=O)[C@@H]1CC2c3cccc4c3c(c(C)n4C)C[C@H]2N(C)C1.CC[C@@H](CO)NC(=O)[C@@H]1C=C2c3cccc4c3c(c(C)n4C)C[C@H]2N(C)C1.
What is the InChIKey of (6aR,9R)-4,7-dimethyl-N-pentan-3-yl-5-(trifluoromethyl)-6,6a,8,9,10,10a-hexahydroindolo[4,3-fg]quinoline-9-carboxamide;(6aR,9R)-5,7-dimethyl-N-pentan-3-yl-4-(trifluoromethyl)-6,6a,8,9,10,10a-hexahydroindolo[4,3-fg]quinoline-9-carboxamide;(6aR,9R)-4,7-dimethyl-N-pentan-3-yl-5-(trifluoromethyl)-6,6a,8,9-tetrahydroindolo[4,3-fg]quinoline-9-carboxamide;(6aR,9R)-5,7-dimethyl-N-pentan-3-yl-4-(trifluoromethyl)-6,6a,8,9-tetrahydroindolo[4,3-fg]quinoline-9-carboxamide;(6aR,9R)-N-[(2S)-1-hydroxybutan-2-yl]-4,5,7-trimethyl-6,6a,8,9-tetrahydroindolo[4,3-fg]quinoline-9-carboxamide;(6aR,9R)-7-methyl-N-pentan-3-yl-4,5-bis(trifluoromethyl)-6,6a,8,9,10,10a-hexahydroindolo[4,3-fg]quinoline-9-carboxamide;(6aR,9R)-7-methyl-N-pentan-3-yl-4,5-bis(trifluoromethyl)-6,6a,8,9-tetrahydroindolo[4,3-fg]quinoline-9-carboxamide;(6aR,9R)-4,5,7-trimethyl-N-pentan-3-yl-6,6a,8,9,10,10a-hexahydroindolo[4,3-fg]quinoline-9-carboxamide?
The InChIKey is VVRLZXGDOMJAAH-SDJXYSSGSA-N. The full InChI is InChI=1S/C23H27F6N3O.C23H25F6N3O.C23H30F3N3O.C23H28F3N3O.C23H30F3N3O.C23H28F3N3O.C23H33N3O.C22H29N3O2/c2*1-4-13(5-2)30-21(33)12-9-15-14-7-6-8-17-19(14)16(10-18(15)31(3)11-12)20(22(24,25)26)32(17)23(27,28)29;2*1-5-14(6-2)27-22(30)13-10-16-15-8-7-9-18-20(15)17(11-19(16)28(3)12-13)21(29(18)4)23(24,25)26;2*1-5-15(6-2)27-22(30)14-10-18-16-8-7-9-19-21(16)17(11-20(18)28(4)12-14)13(3)29(19)23(24,25)26;1-6-16(7-2)24-23(27)15-11-19-17-9-8-10-20-22(17)18(14(3)26(20)5)12-21(19)25(4)13-15;1-5-15(12-26)23-22(27)14-9-18-16-7-6-8-19-21(16)17(13(2)25(19)4)10-20(18)24(3)11-14/h6-8,12-13,15,18H,4-5,9-11H2,1-3H3,(H,30,33);6-9,12-13,18H,4-5,10-11H2,1-3H3,(H,30,33);7-9,13-14,16,19H,5-6,10-12H2,1-4H3,(H,27,30);7-10,13-14,19H,5-6,11-12H2,1-4H3,(H,27,30);7-9,14-15,18,20H,5-6,10-12H2,1-4H3,(H,27,30);7-10,14-15,20H,5-6,11-12H2,1-4H3,(H,27,30);8-10,15-16,19,21H,6-7,11-13H2,1-5H3,(H,24,27);6-9,14-15,20,26H,5,10-12H2,1-4H3,(H,23,27)/t12-,15?,18-;12-,18-;13-,16?,19-;13-,19-;14-,18?,20-;14-,20-;15-,19?,21-;14-,15+,20-/m11111111/s1.
What are the key properties of (6aR,9R)-4,7-dimethyl-N-pentan-3-yl-5-(trifluoromethyl)-6,6a,8,9,10,10a-hexahydroindolo[4,3-fg]quinoline-9-carboxamide;(6aR,9R)-5,7-dimethyl-N-pentan-3-yl-4-(trifluoromethyl)-6,6a,8,9,10,10a-hexahydroindolo[4,3-fg]quinoline-9-carboxamide;(6aR,9R)-4,7-dimethyl-N-pentan-3-yl-5-(trifluoromethyl)-6,6a,8,9-tetrahydroindolo[4,3-fg]quinoline-9-carboxamide;(6aR,9R)-5,7-dimethyl-N-pentan-3-yl-4-(trifluoromethyl)-6,6a,8,9-tetrahydroindolo[4,3-fg]quinoline-9-carboxamide;(6aR,9R)-N-[(2S)-1-hydroxybutan-2-yl]-4,5,7-trimethyl-6,6a,8,9-tetrahydroindolo[4,3-fg]quinoline-9-carboxamide;(6aR,9R)-7-methyl-N-pentan-3-yl-4,5-bis(trifluoromethyl)-6,6a,8,9,10,10a-hexahydroindolo[4,3-fg]quinoline-9-carboxamide;(6aR,9R)-7-methyl-N-pentan-3-yl-4,5-bis(trifluoromethyl)-6,6a,8,9-tetrahydroindolo[4,3-fg]quinoline-9-carboxamide;(6aR,9R)-4,5,7-trimethyl-N-pentan-3-yl-6,6a,8,9,10,10a-hexahydroindolo[4,3-fg]quinoline-9-carboxamide?
(6aR,9R)-4,7-dimethyl-N-pentan-3-yl-5-(trifluoromethyl)-6,6a,8,9,10,10a-hexahydroindolo[4,3-fg]quinoline-9-carboxamide;(6aR,9R)-5,7-dimethyl-N-pentan-3-yl-4-(trifluoromethyl)-6,6a,8,9,10,10a-hexahydroindolo[4,3-fg]quinoline-9-carboxamide;(6aR,9R)-4,7-dimethyl-N-pentan-3-yl-5-(trifluoromethyl)-6,6a,8,9-tetrahydroindolo[4,3-fg]quinoline-9-carboxamide;(6aR,9R)-5,7-dimethyl-N-pentan-3-yl-4-(trifluoromethyl)-6,6a,8,9-tetrahydroindolo[4,3-fg]quinoline-9-carboxamide;(6aR,9R)-N-[(2S)-1-hydroxybutan-2-yl]-4,5,7-trimethyl-6,6a,8,9-tetrahydroindolo[4,3-fg]quinoline-9-carboxamide;(6aR,9R)-7-methyl-N-pentan-3-yl-4,5-bis(trifluoromethyl)-6,6a,8,9,10,10a-hexahydroindolo[4,3-fg]quinoline-9-carboxamide;(6aR,9R)-7-methyl-N-pentan-3-yl-4,5-bis(trifluoromethyl)-6,6a,8,9-tetrahydroindolo[4,3-fg]quinoline-9-carboxamide;(6aR,9R)-4,5,7-trimethyl-N-pentan-3-yl-6,6a,8,9,10,10a-hexahydroindolo[4,3-fg]quinoline-9-carboxamide has a molecular weight of 3365.96 g/mol, XLogP of 34.83, 32 rotatable bonds, 9 hydrogen bond donors, and 25 hydrogen bond acceptors.
Where does this data come from?
All data for (6aR,9R)-4,7-dimethyl-N-pentan-3-yl-5-(trifluoromethyl)-6,6a,8,9,10,10a-hexahydroindolo[4,3-fg]quinoline-9-carboxamide;(6aR,9R)-5,7-dimethyl-N-pentan-3-yl-4-(trifluoromethyl)-6,6a,8,9,10,10a-hexahydroindolo[4,3-fg]quinoline-9-carboxamide;(6aR,9R)-4,7-dimethyl-N-pentan-3-yl-5-(trifluoromethyl)-6,6a,8,9-tetrahydroindolo[4,3-fg]quinoline-9-carboxamide;(6aR,9R)-5,7-dimethyl-N-pentan-3-yl-4-(trifluoromethyl)-6,6a,8,9-tetrahydroindolo[4,3-fg]quinoline-9-carboxamide;(6aR,9R)-N-[(2S)-1-hydroxybutan-2-yl]-4,5,7-trimethyl-6,6a,8,9-tetrahydroindolo[4,3-fg]quinoline-9-carboxamide;(6aR,9R)-7-methyl-N-pentan-3-yl-4,5-bis(trifluoromethyl)-6,6a,8,9,10,10a-hexahydroindolo[4,3-fg]quinoline-9-carboxamide;(6aR,9R)-7-methyl-N-pentan-3-yl-4,5-bis(trifluoromethyl)-6,6a,8,9-tetrahydroindolo[4,3-fg]quinoline-9-carboxamide;(6aR,9R)-4,5,7-trimethyl-N-pentan-3-yl-6,6a,8,9,10,10a-hexahydroindolo[4,3-fg]quinoline-9-carboxamide is sourced from PubChem (CID 161412711), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).