2,5-dimethylpyrido[4,3-b]indol-1-one;ethane;N,N,1,2,4,5-hexamethylpyrrole-3-carboxamide;N,N,1,2,5-pentamethylimidazole-4-carboxamide;N,N,1,2,7-pentamethylindole-3-carboxamide;N,N,1,4,5-pentamethylpyrazole-3-carboxamide;N,N,1,7-tetramethylindazole-3-carboxamide;N,N,1,3-tetramethylindole-2-carboxamide;N,N,2,11-tetramethyl-9-oxa-1-azatricyclo[6.3.1.04,12]dodeca-2,4(12),5,7-tetraene-3-carboxamide;1,2,3,5-tetramethylpyrrolo[3,2-c]pyridin-4-one;N,N,11-trimethyl-9-oxa-1,2-diazatricyclo[6.3.1.04,12]dodeca-2,4(12),5,7-tetraene-3-carboxamide

C136H204N24O12 — CID 158207905

About 2,5-dimethylpyrido[4,3-b]indol-1-one;ethane;N,N,1,2,4,5-hexamethylpyrrole-3-carboxamide;N,N,1,2,5-pentamethylimidazole-4-carboxamide;N,N,1,2,7-pentamethylindole-3-carboxamide;N,N,1,4,5-pentamethylpyrazole-3-carboxamide;N,N,1,7-tetramethylindazole-3-carboxamide;N,N,1,3-tetramethylindole-2-carboxamide;N,N,2,11-tetramethyl-9-oxa-1-azatricyclo[6.3.1.04,12]dodeca-2,4(12),5,7-tetraene-3-carboxamide;1,2,3,5-tetramethylpyrrolo[3,2-c]pyridin-4-one;N,N,11-trimethyl-9-oxa-1,2-diazatricyclo[6.3.1.04,12]dodeca-2,4(12),5,7-tetraene-3-carboxamide

2,5-dimethylpyrido[4,3-b]indol-1-one;ethane;N,N,1,2,4,5-hexamethylpyrrole-3-carboxamide;N,N,1,2,5-pentamethylimidazole-4-carboxamide;N,N,1,2,7-pentamethylindole-3-carboxamide;N,N,1,4,5-pentamethylpyrazole-3-carboxamide;N,N,1,7-tetramethylindazole-3-carboxamide;N,N,1,3-tetramethylindole-2-carboxamide;N,N,2,11-tetramethyl-9-oxa-1-azatricyclo[6.3.1.04,12]dodeca-2,4(12),5,7-tetraene-3-carboxamide;1,2,3,5-tetramethylpyrrolo[3,2-c]pyridin-4-one;N,N,11-trimethyl-9-oxa-1,2-diazatricyclo[6.3.1.04,12]dodeca-2,4(12),5,7-tetraene-3-carboxamide (PubChem CID 158207905) has the molecular formula C136H204N24O12 and a molecular weight of 2367.28 g/mol. Its IUPAC name is 2,5-dimethylpyrido[4,3-b]indol-1-one;ethane;N,N,1,2,4,5-hexamethylpyrrole-3-carboxamide;N,N,1,2,5-pentamethylimidazole-4-carboxamide;N,N,1,2,7-pentamethylindole-3-carboxamide;N,N,1,4,5-pentamethylpyrazole-3-carboxamide;N,N,1,7-tetramethylindazole-3-carboxamide;N,N,1,3-tetramethylindole-2-carboxamide;N,N,2,11-tetramethyl-9-oxa-1-azatricyclo[6.3.1.04,12]dodeca-2,4(12),5,7-tetraene-3-carboxamide;1,2,3,5-tetramethylpyrrolo[3,2-c]pyridin-4-one;N,N,11-trimethyl-9-oxa-1,2-diazatricyclo[6.3.1.04,12]dodeca-2,4(12),5,7-tetraene-3-carboxamide.

Molecular Properties

• Compound Name: 2,5-dimethylpyrido[4,3-b]indol-1-one;ethane;N,N,1,2,4,5-hexamethylpyrrole-3-carboxamide;N,N,1,2,5-pentamethylimidazole-4-carboxamide;N,N,1,2,7-pentamethylindole-3-carboxamide;N,N,1,4,5-pentamethylpyrazole-3-carboxamide;N,N,1,7-tetramethylindazole-3-carboxamide;N,N,1,3-tetramethylindole-2-carboxamide;N,N,2,11-tetramethyl-9-oxa-1-azatricyclo[6.3.1.04,12]dodeca-2,4(12),5,7-tetraene-3-carboxamide;1,2,3,5-tetramethylpyrrolo[3,2-c]pyridin-4-one;N,N,11-trimethyl-9-oxa-1,2-diazatricyclo[6.3.1.04,12]dodeca-2,4(12),5,7-tetraene-3-carboxamide
• PubChem CID: 158207905
• Molecular Formula: C136H204N24O12
• Molecular Weight: 2367.28 g/mol
• Exact Mass: 2365.61
• IUPAC Name: 2,5-dimethylpyrido[4,3-b]indol-1-one;ethane;N,N,1,2,4,5-hexamethylpyrrole-3-carboxamide;N,N,1,2,5-pentamethylimidazole-4-carboxamide;N,N,1,2,7-pentamethylindole-3-carboxamide;N,N,1,4,5-pentamethylpyrazole-3-carboxamide;N,N,1,7-tetramethylindazole-3-carboxamide;N,N,1,3-tetramethylindole-2-carboxamide;N,N,2,11-tetramethyl-9-oxa-1-azatricyclo[6.3.1.04,12]dodeca-2,4(12),5,7-tetraene-3-carboxamide;1,2,3,5-tetramethylpyrrolo[3,2-c]pyridin-4-one;N,N,11-trimethyl-9-oxa-1,2-diazatricyclo[6.3.1.04,12]dodeca-2,4(12),5,7-tetraene-3-carboxamide
• SMILES: CC.CC.CC.CC.CC.CC.CC.CC.CC1COc2cccc3c(C(=O)N(C)C)nn1c23.Cc1c(C(=O)N(C)C)c(C)n(C)c1C.Cc1c(C(=O)N(C)C)c2cccc3c2n1C(C)CO3.Cc1c(C(=O)N(C)C)n(C)c2ccccc12.Cc1c(C(=O)N(C)C)nn(C)c1C.Cc1c(C)n(C)c2ccn(C)c(=O)c12.Cc1cccc2c(C(=O)N(C)C)c(C)n(C)c12.Cc1cccc2c(C(=O)N(C)C)nn(C)c12.Cc1nc(C(=O)N(C)C)c(C)n1C.Cn1ccc2c(c1=O)c1ccccc1n2C
• InChI: InChI=1S/C15H18N2O2.C14H18N2O.C13H15N3O2.C13H12N2O.C13H16N2O.C12H15N3O.C11H14N2O.C11H18N2O.2C9H15N3O.8C2H6/c1-9-8-19-12-7-5-6-11-13(15(18)16(3)4)10(2)17(9)14(11)12;1-9-7-6-8-11-12(14(17)15(3)4)10(2)16(5)13(9)11;1-8-7-18-10-6-4-5-9-11(13(17)15(2)3)14-16(8)12(9)10;1-14-8-7-11-12(13(14)16)9-5-3-4-6-10(9)15(11)2;1-9-10-7-5-6-8-11(10)15(4)12(9)13(16)14(2)3;1-8-6-5-7-9-10(12(16)14(2)3)13-15(4)11(8)9;1-7-8(2)13(4)9-5-6-12(3)11(14)10(7)9;1-7-8(2)13(6)9(3)10(7)11(14)12(4)5;1-6-8(9(13)11(3)4)10-7(2)12(6)5;1-6-7(2)12(5)10-8(6)9(13)11(3)4;8*1-2/h5-7,9H,8H2,1-4H3;6-8H,1-5H3;4-6,8H,7H2,1-3H3;3-8H,1-2H3;5-8H,1-4H3;5-7H,1-4H3;5-6H,1-4H3;1-6H3;2*1-5H3;8*1-2H3
• InChIKey: GBSIAEWPXJREIS-UHFFFAOYSA-N
• XLogP: 25.43
• TPSA: 325.80 Ų
• H-Bond Acceptors: 28
• Rotatable Bonds: 8
• Heavy Atoms: 172
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2367.28
LogP ≤ 5	25.43
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	28

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 2,5-dimethylpyrido[4,3-b]indol-1-one;ethane;N,N,1,2,4,5-hexamethylpyrrole-3-carboxamide;N,N,1,2,5-pentamethylimidazole-4-carboxamide;N,N,1,2,7-pentamethylindole-3-carboxamide;N,N,1,4,5-pentamethylpyrazole-3-carboxamide;N,N,1,7-tetramethylindazole-3-carboxamide;N,N,1,3-tetramethylindole-2-carboxamide;N,N,2,11-tetramethyl-9-oxa-1-azatricyclo[6.3.1.04,12]dodeca-2,4(12),5,7-tetraene-3-carboxamide;1,2,3,5-tetramethylpyrrolo[3,2-c]pyridin-4-one;N,N,11-trimethyl-9-oxa-1,2-diazatricyclo[6.3.1.04,12]dodeca-2,4(12),5,7-tetraene-3-carboxamide?

The IUPAC name of 2,5-dimethylpyrido[4,3-b]indol-1-one;ethane;N,N,1,2,4,5-hexamethylpyrrole-3-carboxamide;N,N,1,2,5-pentamethylimidazole-4-carboxamide;N,N,1,2,7-pentamethylindole-3-carboxamide;N,N,1,4,5-pentamethylpyrazole-3-carboxamide;N,N,1,7-tetramethylindazole-3-carboxamide;N,N,1,3-tetramethylindole-2-carboxamide;N,N,2,11-tetramethyl-9-oxa-1-azatricyclo[6.3.1.04,12]dodeca-2,4(12),5,7-tetraene-3-carboxamide;1,2,3,5-tetramethylpyrrolo[3,2-c]pyridin-4-one;N,N,11-trimethyl-9-oxa-1,2-diazatricyclo[6.3.1.04,12]dodeca-2,4(12),5,7-tetraene-3-carboxamide (CID 158207905) is 2,5-dimethylpyrido[4,3-b]indol-1-one;ethane;N,N,1,2,4,5-hexamethylpyrrole-3-carboxamide;N,N,1,2,5-pentamethylimidazole-4-carboxamide;N,N,1,2,7-pentamethylindole-3-carboxamide;N,N,1,4,5-pentamethylpyrazole-3-carboxamide;N,N,1,7-tetramethylindazole-3-carboxamide;N,N,1,3-tetramethylindole-2-carboxamide;N,N,2,11-tetramethyl-9-oxa-1-azatricyclo[6.3.1.04,12]dodeca-2,4(12),5,7-tetraene-3-carboxamide;1,2,3,5-tetramethylpyrrolo[3,2-c]pyridin-4-one;N,N,11-trimethyl-9-oxa-1,2-diazatricyclo[6.3.1.04,12]dodeca-2,4(12),5,7-tetraene-3-carboxamide.

What is the SMILES notation for 2,5-dimethylpyrido[4,3-b]indol-1-one;ethane;N,N,1,2,4,5-hexamethylpyrrole-3-carboxamide;N,N,1,2,5-pentamethylimidazole-4-carboxamide;N,N,1,2,7-pentamethylindole-3-carboxamide;N,N,1,4,5-pentamethylpyrazole-3-carboxamide;N,N,1,7-tetramethylindazole-3-carboxamide;N,N,1,3-tetramethylindole-2-carboxamide;N,N,2,11-tetramethyl-9-oxa-1-azatricyclo[6.3.1.04,12]dodeca-2,4(12),5,7-tetraene-3-carboxamide;1,2,3,5-tetramethylpyrrolo[3,2-c]pyridin-4-one;N,N,11-trimethyl-9-oxa-1,2-diazatricyclo[6.3.1.04,12]dodeca-2,4(12),5,7-tetraene-3-carboxamide?

The canonical SMILES for 2,5-dimethylpyrido[4,3-b]indol-1-one;ethane;N,N,1,2,4,5-hexamethylpyrrole-3-carboxamide;N,N,1,2,5-pentamethylimidazole-4-carboxamide;N,N,1,2,7-pentamethylindole-3-carboxamide;N,N,1,4,5-pentamethylpyrazole-3-carboxamide;N,N,1,7-tetramethylindazole-3-carboxamide;N,N,1,3-tetramethylindole-2-carboxamide;N,N,2,11-tetramethyl-9-oxa-1-azatricyclo[6.3.1.04,12]dodeca-2,4(12),5,7-tetraene-3-carboxamide;1,2,3,5-tetramethylpyrrolo[3,2-c]pyridin-4-one;N,N,11-trimethyl-9-oxa-1,2-diazatricyclo[6.3.1.04,12]dodeca-2,4(12),5,7-tetraene-3-carboxamide is CC.CC.CC.CC.CC.CC.CC.CC.CC1COc2cccc3c(C(=O)N(C)C)nn1c23.Cc1c(C(=O)N(C)C)c(C)n(C)c1C.Cc1c(C(=O)N(C)C)c2cccc3c2n1C(C)CO3.Cc1c(C(=O)N(C)C)n(C)c2ccccc12.Cc1c(C(=O)N(C)C)nn(C)c1C.Cc1c(C)n(C)c2ccn(C)c(=O)c12.Cc1cccc2c(C(=O)N(C)C)c(C)n(C)c12.Cc1cccc2c(C(=O)N(C)C)nn(C)c12.Cc1nc(C(=O)N(C)C)c(C)n1C.Cn1ccc2c(c1=O)c1ccccc1n2C.

What is the InChIKey of 2,5-dimethylpyrido[4,3-b]indol-1-one;ethane;N,N,1,2,4,5-hexamethylpyrrole-3-carboxamide;N,N,1,2,5-pentamethylimidazole-4-carboxamide;N,N,1,2,7-pentamethylindole-3-carboxamide;N,N,1,4,5-pentamethylpyrazole-3-carboxamide;N,N,1,7-tetramethylindazole-3-carboxamide;N,N,1,3-tetramethylindole-2-carboxamide;N,N,2,11-tetramethyl-9-oxa-1-azatricyclo[6.3.1.04,12]dodeca-2,4(12),5,7-tetraene-3-carboxamide;1,2,3,5-tetramethylpyrrolo[3,2-c]pyridin-4-one;N,N,11-trimethyl-9-oxa-1,2-diazatricyclo[6.3.1.04,12]dodeca-2,4(12),5,7-tetraene-3-carboxamide?

The InChIKey is GBSIAEWPXJREIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O2.C14H18N2O.C13H15N3O2.C13H12N2O.C13H16N2O.C12H15N3O.C11H14N2O.C11H18N2O.2C9H15N3O.8C2H6/c1-9-8-19-12-7-5-6-11-13(15(18)16(3)4)10(2)17(9)14(11)12;1-9-7-6-8-11-12(14(17)15(3)4)10(2)16(5)13(9)11;1-8-7-18-10-6-4-5-9-11(13(17)15(2)3)14-16(8)12(9)10;1-14-8-7-11-12(13(14)16)9-5-3-4-6-10(9)15(11)2;1-9-10-7-5-6-8-11(10)15(4)12(9)13(16)14(2)3;1-8-6-5-7-9-10(12(16)14(2)3)13-15(4)11(8)9;1-7-8(2)13(4)9-5-6-12(3)11(14)10(7)9;1-7-8(2)13(6)9(3)10(7)11(14)12(4)5;1-6-8(9(13)11(3)4)10-7(2)12(6)5;1-6-7(2)12(5)10-8(6)9(13)11(3)4;8*1-2/h5-7,9H,8H2,1-4H3;6-8H,1-5H3;4-6,8H,7H2,1-3H3;3-8H,1-2H3;5-8H,1-4H3;5-7H,1-4H3;5-6H,1-4H3;1-6H3;2*1-5H3;8*1-2H3.

What are the key properties of 2,5-dimethylpyrido[4,3-b]indol-1-one;ethane;N,N,1,2,4,5-hexamethylpyrrole-3-carboxamide;N,N,1,2,5-pentamethylimidazole-4-carboxamide;N,N,1,2,7-pentamethylindole-3-carboxamide;N,N,1,4,5-pentamethylpyrazole-3-carboxamide;N,N,1,7-tetramethylindazole-3-carboxamide;N,N,1,3-tetramethylindole-2-carboxamide;N,N,2,11-tetramethyl-9-oxa-1-azatricyclo[6.3.1.04,12]dodeca-2,4(12),5,7-tetraene-3-carboxamide;1,2,3,5-tetramethylpyrrolo[3,2-c]pyridin-4-one;N,N,11-trimethyl-9-oxa-1,2-diazatricyclo[6.3.1.04,12]dodeca-2,4(12),5,7-tetraene-3-carboxamide?

2,5-dimethylpyrido[4,3-b]indol-1-one;ethane;N,N,1,2,4,5-hexamethylpyrrole-3-carboxamide;N,N,1,2,5-pentamethylimidazole-4-carboxamide;N,N,1,2,7-pentamethylindole-3-carboxamide;N,N,1,4,5-pentamethylpyrazole-3-carboxamide;N,N,1,7-tetramethylindazole-3-carboxamide;N,N,1,3-tetramethylindole-2-carboxamide;N,N,2,11-tetramethyl-9-oxa-1-azatricyclo[6.3.1.04,12]dodeca-2,4(12),5,7-tetraene-3-carboxamide;1,2,3,5-tetramethylpyrrolo[3,2-c]pyridin-4-one;N,N,11-trimethyl-9-oxa-1,2-diazatricyclo[6.3.1.04,12]dodeca-2,4(12),5,7-tetraene-3-carboxamide has a molecular weight of 2367.28 g/mol, XLogP of 25.43, 8 rotatable bonds, 0 hydrogen bond donors, and 28 hydrogen bond acceptors.

Where does this data come from?

All data for 2,5-dimethylpyrido[4,3-b]indol-1-one;ethane;N,N,1,2,4,5-hexamethylpyrrole-3-carboxamide;N,N,1,2,5-pentamethylimidazole-4-carboxamide;N,N,1,2,7-pentamethylindole-3-carboxamide;N,N,1,4,5-pentamethylpyrazole-3-carboxamide;N,N,1,7-tetramethylindazole-3-carboxamide;N,N,1,3-tetramethylindole-2-carboxamide;N,N,2,11-tetramethyl-9-oxa-1-azatricyclo[6.3.1.04,12]dodeca-2,4(12),5,7-tetraene-3-carboxamide;1,2,3,5-tetramethylpyrrolo[3,2-c]pyridin-4-one;N,N,11-trimethyl-9-oxa-1,2-diazatricyclo[6.3.1.04,12]dodeca-2,4(12),5,7-tetraene-3-carboxamide is sourced from PubChem (CID 158207905), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).