(6aR,9R)-N,N-diethyl-7-methyl-6,6a,8,9-tetrahydro-4H-indolo[4,3-fg]quinoline-9-carboxamide;(6aR,9R)-N,N-diethyl-7-prop-2-enyl-6,6a,8,9-tetrahydro-4H-indolo[4,3-fg]quinoline-9-carboxamide;3-[2-(dimethylamino)ethyl]-1-methylindol-4-ol;(1R,15S)-17-ethyl-7-methoxy-3,13-diazapentacyclo[13.3.1.02,10.04,9.013,18]nonadeca-2(10),4(9),5,7-tetraene;1-(5-methoxy-1H-indol-3-yl)propan-2-amine;7-methoxy-1-methyl-4,9-dihydro-3H-pyrido[3,4-b]indole;7-methoxy-1-methyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole

C113H142N16O7 — CID 159162658

About (6aR,9R)-N,N-diethyl-7-methyl-6,6a,8,9-tetrahydro-4H-indolo[4,3-fg]quinoline-9-carboxamide;(6aR,9R)-N,N-diethyl-7-prop-2-enyl-6,6a,8,9-tetrahydro-4H-indolo[4,3-fg]quinoline-9-carboxamide;3-[2-(dimethylamino)ethyl]-1-methylindol-4-ol;(1R,15S)-17-ethyl-7-methoxy-3,13-diazapentacyclo[13.3.1.02,10.04,9.013,18]nonadeca-2(10),4(9),5,7-tetraene;1-(5-methoxy-1H-indol-3-yl)propan-2-amine;7-methoxy-1-methyl-4,9-dihydro-3H-pyrido[3,4-b]indole;7-methoxy-1-methyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole

(6aR,9R)-N,N-diethyl-7-methyl-6,6a,8,9-tetrahydro-4H-indolo[4,3-fg]quinoline-9-carboxamide;(6aR,9R)-N,N-diethyl-7-prop-2-enyl-6,6a,8,9-tetrahydro-4H-indolo[4,3-fg]quinoline-9-carboxamide;3-[2-(dimethylamino)ethyl]-1-methylindol-4-ol;(1R,15S)-17-ethyl-7-methoxy-3,13-diazapentacyclo[13.3.1.02,10.04,9.013,18]nonadeca-2(10),4(9),5,7-tetraene;1-(5-methoxy-1H-indol-3-yl)propan-2-amine;7-methoxy-1-methyl-4,9-dihydro-3H-pyrido[3,4-b]indole;7-methoxy-1-methyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole (PubChem CID 159162658) has the molecular formula C113H142N16O7 and a molecular weight of 1836.48 g/mol. Its IUPAC name is (6aR,9R)-N,N-diethyl-7-methyl-6,6a,8,9-tetrahydro-4H-indolo[4,3-fg]quinoline-9-carboxamide;(6aR,9R)-N,N-diethyl-7-prop-2-enyl-6,6a,8,9-tetrahydro-4H-indolo[4,3-fg]quinoline-9-carboxamide;3-[2-(dimethylamino)ethyl]-1-methylindol-4-ol;(1R,15S)-17-ethyl-7-methoxy-3,13-diazapentacyclo[13.3.1.02,10.04,9.013,18]nonadeca-2(10),4(9),5,7-tetraene;1-(5-methoxy-1H-indol-3-yl)propan-2-amine;7-methoxy-1-methyl-4,9-dihydro-3H-pyrido[3,4-b]indole;7-methoxy-1-methyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole.

Molecular Properties

• Compound Name: (6aR,9R)-N,N-diethyl-7-methyl-6,6a,8,9-tetrahydro-4H-indolo[4,3-fg]quinoline-9-carboxamide;(6aR,9R)-N,N-diethyl-7-prop-2-enyl-6,6a,8,9-tetrahydro-4H-indolo[4,3-fg]quinoline-9-carboxamide;3-[2-(dimethylamino)ethyl]-1-methylindol-4-ol;(1R,15S)-17-ethyl-7-methoxy-3,13-diazapentacyclo[13.3.1.02,10.04,9.013,18]nonadeca-2(10),4(9),5,7-tetraene;1-(5-methoxy-1H-indol-3-yl)propan-2-amine;7-methoxy-1-methyl-4,9-dihydro-3H-pyrido[3,4-b]indole;7-methoxy-1-methyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole
• PubChem CID: 159162658
• Molecular Formula: C113H142N16O7
• Molecular Weight: 1836.48 g/mol
• Exact Mass: 1835.12
• IUPAC Name: (6aR,9R)-N,N-diethyl-7-methyl-6,6a,8,9-tetrahydro-4H-indolo[4,3-fg]quinoline-9-carboxamide;(6aR,9R)-N,N-diethyl-7-prop-2-enyl-6,6a,8,9-tetrahydro-4H-indolo[4,3-fg]quinoline-9-carboxamide;3-[2-(dimethylamino)ethyl]-1-methylindol-4-ol;(1R,15S)-17-ethyl-7-methoxy-3,13-diazapentacyclo[13.3.1.02,10.04,9.013,18]nonadeca-2(10),4(9),5,7-tetraene;1-(5-methoxy-1H-indol-3-yl)propan-2-amine;7-methoxy-1-methyl-4,9-dihydro-3H-pyrido[3,4-b]indole;7-methoxy-1-methyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole
• SMILES: C=CCN1C[C@H](C(=O)N(CC)CC)C=C2c3cccc4[nH]cc(c34)C[C@H]21.CCC1C[C@H]2C[C@H]3c4[nH]c5ccc(OC)cc5c4CCN(C2)C13.CCN(CC)C(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1.CN(C)CCc1cn(C)c2cccc(O)c12.COc1ccc2[nH]cc(CC(C)N)c2c1.COc1ccc2c3c([nH]c2c1)C(C)=NCC3.COc1ccc2c3c([nH]c2c1)C(C)NCC3
• InChI: InChI=1S/C22H27N3O.C20H25N3O.C20H26N2O.C13H16N2O.C13H14N2O.C13H18N2O.C12H16N2O/c1-4-10-25-14-16(22(26)24(5-2)6-3)11-18-17-8-7-9-19-21(17)15(13-23-19)12-20(18)25;1-4-23(5-2)20(24)14-9-16-15-7-6-8-17-19(15)13(11-21-17)10-18(16)22(3)12-14;1-3-13-8-12-9-17-19-15(6-7-22(11-12)20(13)17)16-10-14(23-2)4-5-18(16)21-19;2*1-8-13-11(5-6-14-8)10-4-3-9(16-2)7-12(10)15-13;1-14(2)8-7-10-9-15(3)11-5-4-6-12(16)13(10)11;1-8(13)5-9-7-14-12-4-3-10(15-2)6-11(9)12/h4,7-9,11,13,16,20,23H,1,5-6,10,12,14H2,2-3H3;6-9,11,14,18,21H,4-5,10,12H2,1-3H3;4-5,10,12-13,17,20-21H,3,6-9,11H2,1-2H3;3-4,7-8,14-15H,5-6H2,1-2H3;3-4,7,15H,5-6H2,1-2H3;4-6,9,16H,7-8H2,1-3H3;3-4,6-8,14H,5,13H2,1-2H3/t16-,20-;14-,18-;12-,13?,17-,20?;;;;/m110..../s1
• InChIKey: KKROZRDOFZOKSN-SBEMHRERSA-N
• XLogP: 19.28
• TPSA: 260.81 Ų
• H-Bond Donors: 9
• H-Bond Acceptors: 15
• Rotatable Bonds: 18
• Heavy Atoms: 136
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1836.48
LogP ≤ 5	19.28
H-Bond Donors ≤ 5	9
H-Bond Acceptors ≤ 10	15

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'indol_3yl_alk(461)', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of (6aR,9R)-N,N-diethyl-7-methyl-6,6a,8,9-tetrahydro-4H-indolo[4,3-fg]quinoline-9-carboxamide;(6aR,9R)-N,N-diethyl-7-prop-2-enyl-6,6a,8,9-tetrahydro-4H-indolo[4,3-fg]quinoline-9-carboxamide;3-[2-(dimethylamino)ethyl]-1-methylindol-4-ol;(1R,15S)-17-ethyl-7-methoxy-3,13-diazapentacyclo[13.3.1.02,10.04,9.013,18]nonadeca-2(10),4(9),5,7-tetraene;1-(5-methoxy-1H-indol-3-yl)propan-2-amine;7-methoxy-1-methyl-4,9-dihydro-3H-pyrido[3,4-b]indole;7-methoxy-1-methyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole?

The IUPAC name of (6aR,9R)-N,N-diethyl-7-methyl-6,6a,8,9-tetrahydro-4H-indolo[4,3-fg]quinoline-9-carboxamide;(6aR,9R)-N,N-diethyl-7-prop-2-enyl-6,6a,8,9-tetrahydro-4H-indolo[4,3-fg]quinoline-9-carboxamide;3-[2-(dimethylamino)ethyl]-1-methylindol-4-ol;(1R,15S)-17-ethyl-7-methoxy-3,13-diazapentacyclo[13.3.1.02,10.04,9.013,18]nonadeca-2(10),4(9),5,7-tetraene;1-(5-methoxy-1H-indol-3-yl)propan-2-amine;7-methoxy-1-methyl-4,9-dihydro-3H-pyrido[3,4-b]indole;7-methoxy-1-methyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole (CID 159162658) is (6aR,9R)-N,N-diethyl-7-methyl-6,6a,8,9-tetrahydro-4H-indolo[4,3-fg]quinoline-9-carboxamide;(6aR,9R)-N,N-diethyl-7-prop-2-enyl-6,6a,8,9-tetrahydro-4H-indolo[4,3-fg]quinoline-9-carboxamide;3-[2-(dimethylamino)ethyl]-1-methylindol-4-ol;(1R,15S)-17-ethyl-7-methoxy-3,13-diazapentacyclo[13.3.1.02,10.04,9.013,18]nonadeca-2(10),4(9),5,7-tetraene;1-(5-methoxy-1H-indol-3-yl)propan-2-amine;7-methoxy-1-methyl-4,9-dihydro-3H-pyrido[3,4-b]indole;7-methoxy-1-methyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole.

What is the SMILES notation for (6aR,9R)-N,N-diethyl-7-methyl-6,6a,8,9-tetrahydro-4H-indolo[4,3-fg]quinoline-9-carboxamide;(6aR,9R)-N,N-diethyl-7-prop-2-enyl-6,6a,8,9-tetrahydro-4H-indolo[4,3-fg]quinoline-9-carboxamide;3-[2-(dimethylamino)ethyl]-1-methylindol-4-ol;(1R,15S)-17-ethyl-7-methoxy-3,13-diazapentacyclo[13.3.1.02,10.04,9.013,18]nonadeca-2(10),4(9),5,7-tetraene;1-(5-methoxy-1H-indol-3-yl)propan-2-amine;7-methoxy-1-methyl-4,9-dihydro-3H-pyrido[3,4-b]indole;7-methoxy-1-methyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole?

The canonical SMILES for (6aR,9R)-N,N-diethyl-7-methyl-6,6a,8,9-tetrahydro-4H-indolo[4,3-fg]quinoline-9-carboxamide;(6aR,9R)-N,N-diethyl-7-prop-2-enyl-6,6a,8,9-tetrahydro-4H-indolo[4,3-fg]quinoline-9-carboxamide;3-[2-(dimethylamino)ethyl]-1-methylindol-4-ol;(1R,15S)-17-ethyl-7-methoxy-3,13-diazapentacyclo[13.3.1.02,10.04,9.013,18]nonadeca-2(10),4(9),5,7-tetraene;1-(5-methoxy-1H-indol-3-yl)propan-2-amine;7-methoxy-1-methyl-4,9-dihydro-3H-pyrido[3,4-b]indole;7-methoxy-1-methyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole is C=CCN1C[C@H](C(=O)N(CC)CC)C=C2c3cccc4[nH]cc(c34)C[C@H]21.CCC1C[C@H]2C[C@H]3c4[nH]c5ccc(OC)cc5c4CCN(C2)C13.CCN(CC)C(=O)[C@@H]1C=C2c3cccc4[nH]cc(c34)C[C@H]2N(C)C1.CN(C)CCc1cn(C)c2cccc(O)c12.COc1ccc2[nH]cc(CC(C)N)c2c1.COc1ccc2c3c([nH]c2c1)C(C)=NCC3.COc1ccc2c3c([nH]c2c1)C(C)NCC3.

What is the InChIKey of (6aR,9R)-N,N-diethyl-7-methyl-6,6a,8,9-tetrahydro-4H-indolo[4,3-fg]quinoline-9-carboxamide;(6aR,9R)-N,N-diethyl-7-prop-2-enyl-6,6a,8,9-tetrahydro-4H-indolo[4,3-fg]quinoline-9-carboxamide;3-[2-(dimethylamino)ethyl]-1-methylindol-4-ol;(1R,15S)-17-ethyl-7-methoxy-3,13-diazapentacyclo[13.3.1.02,10.04,9.013,18]nonadeca-2(10),4(9),5,7-tetraene;1-(5-methoxy-1H-indol-3-yl)propan-2-amine;7-methoxy-1-methyl-4,9-dihydro-3H-pyrido[3,4-b]indole;7-methoxy-1-methyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole?

The InChIKey is KKROZRDOFZOKSN-SBEMHRERSA-N. The full InChI is InChI=1S/C22H27N3O.C20H25N3O.C20H26N2O.C13H16N2O.C13H14N2O.C13H18N2O.C12H16N2O/c1-4-10-25-14-16(22(26)24(5-2)6-3)11-18-17-8-7-9-19-21(17)15(13-23-19)12-20(18)25;1-4-23(5-2)20(24)14-9-16-15-7-6-8-17-19(15)13(11-21-17)10-18(16)22(3)12-14;1-3-13-8-12-9-17-19-15(6-7-22(11-12)20(13)17)16-10-14(23-2)4-5-18(16)21-19;2*1-8-13-11(5-6-14-8)10-4-3-9(16-2)7-12(10)15-13;1-14(2)8-7-10-9-15(3)11-5-4-6-12(16)13(10)11;1-8(13)5-9-7-14-12-4-3-10(15-2)6-11(9)12/h4,7-9,11,13,16,20,23H,1,5-6,10,12,14H2,2-3H3;6-9,11,14,18,21H,4-5,10,12H2,1-3H3;4-5,10,12-13,17,20-21H,3,6-9,11H2,1-2H3;3-4,7-8,14-15H,5-6H2,1-2H3;3-4,7,15H,5-6H2,1-2H3;4-6,9,16H,7-8H2,1-3H3;3-4,6-8,14H,5,13H2,1-2H3/t16-,20-;14-,18-;12-,13?,17-,20?;;;;/m110..../s1.

What are the key properties of (6aR,9R)-N,N-diethyl-7-methyl-6,6a,8,9-tetrahydro-4H-indolo[4,3-fg]quinoline-9-carboxamide;(6aR,9R)-N,N-diethyl-7-prop-2-enyl-6,6a,8,9-tetrahydro-4H-indolo[4,3-fg]quinoline-9-carboxamide;3-[2-(dimethylamino)ethyl]-1-methylindol-4-ol;(1R,15S)-17-ethyl-7-methoxy-3,13-diazapentacyclo[13.3.1.02,10.04,9.013,18]nonadeca-2(10),4(9),5,7-tetraene;1-(5-methoxy-1H-indol-3-yl)propan-2-amine;7-methoxy-1-methyl-4,9-dihydro-3H-pyrido[3,4-b]indole;7-methoxy-1-methyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole?

(6aR,9R)-N,N-diethyl-7-methyl-6,6a,8,9-tetrahydro-4H-indolo[4,3-fg]quinoline-9-carboxamide;(6aR,9R)-N,N-diethyl-7-prop-2-enyl-6,6a,8,9-tetrahydro-4H-indolo[4,3-fg]quinoline-9-carboxamide;3-[2-(dimethylamino)ethyl]-1-methylindol-4-ol;(1R,15S)-17-ethyl-7-methoxy-3,13-diazapentacyclo[13.3.1.02,10.04,9.013,18]nonadeca-2(10),4(9),5,7-tetraene;1-(5-methoxy-1H-indol-3-yl)propan-2-amine;7-methoxy-1-methyl-4,9-dihydro-3H-pyrido[3,4-b]indole;7-methoxy-1-methyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole has a molecular weight of 1836.48 g/mol, XLogP of 19.28, 18 rotatable bonds, 9 hydrogen bond donors, and 15 hydrogen bond acceptors.

Where does this data come from?

All data for (6aR,9R)-N,N-diethyl-7-methyl-6,6a,8,9-tetrahydro-4H-indolo[4,3-fg]quinoline-9-carboxamide;(6aR,9R)-N,N-diethyl-7-prop-2-enyl-6,6a,8,9-tetrahydro-4H-indolo[4,3-fg]quinoline-9-carboxamide;3-[2-(dimethylamino)ethyl]-1-methylindol-4-ol;(1R,15S)-17-ethyl-7-methoxy-3,13-diazapentacyclo[13.3.1.02,10.04,9.013,18]nonadeca-2(10),4(9),5,7-tetraene;1-(5-methoxy-1H-indol-3-yl)propan-2-amine;7-methoxy-1-methyl-4,9-dihydro-3H-pyrido[3,4-b]indole;7-methoxy-1-methyl-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole is sourced from PubChem (CID 159162658), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).