2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazole-6-carboxamide;(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)methylurea;2-[[2,10-difluoro-12-(trifluoromethyl)-5,7-dihydroindolo[2,3-b]carbazol-6-yl]oxy]-N,N-dimethylethanamine;methyl 6-[2-(diethylamino)ethoxy]-10-(formyloxymethyl)-5,7-dihydroindolo[2,3-b]carbazole-2-carboxylate

C90H72F9N13O8 — CID 159232267

About 2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazole-6-carboxamide;(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)methylurea;2-[[2,10-difluoro-12-(trifluoromethyl)-5,7-dihydroindolo[2,3-b]carbazol-6-yl]oxy]-N,N-dimethylethanamine;methyl 6-[2-(diethylamino)ethoxy]-10-(formyloxymethyl)-5,7-dihydroindolo[2,3-b]carbazole-2-carboxylate

2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazole-6-carboxamide;(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)methylurea;2-[[2,10-difluoro-12-(trifluoromethyl)-5,7-dihydroindolo[2,3-b]carbazol-6-yl]oxy]-N,N-dimethylethanamine;methyl 6-[2-(diethylamino)ethoxy]-10-(formyloxymethyl)-5,7-dihydroindolo[2,3-b]carbazole-2-carboxylate (PubChem CID 159232267) has the molecular formula C90H72F9N13O8 and a molecular weight of 1634.63 g/mol. Its IUPAC name is 2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazole-6-carboxamide;(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)methylurea;2-[[2,10-difluoro-12-(trifluoromethyl)-5,7-dihydroindolo[2,3-b]carbazol-6-yl]oxy]-N,N-dimethylethanamine;methyl 6-[2-(diethylamino)ethoxy]-10-(formyloxymethyl)-5,7-dihydroindolo[2,3-b]carbazole-2-carboxylate.

Molecular Properties

• Compound Name: 2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazole-6-carboxamide;(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)methylurea;2-[[2,10-difluoro-12-(trifluoromethyl)-5,7-dihydroindolo[2,3-b]carbazol-6-yl]oxy]-N,N-dimethylethanamine;methyl 6-[2-(diethylamino)ethoxy]-10-(formyloxymethyl)-5,7-dihydroindolo[2,3-b]carbazole-2-carboxylate
• PubChem CID: 159232267
• Molecular Formula: C90H72F9N13O8
• Molecular Weight: 1634.63 g/mol
• Exact Mass: 1633.55
• IUPAC Name: 2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazole-6-carboxamide;(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)methylurea;2-[[2,10-difluoro-12-(trifluoromethyl)-5,7-dihydroindolo[2,3-b]carbazol-6-yl]oxy]-N,N-dimethylethanamine;methyl 6-[2-(diethylamino)ethoxy]-10-(formyloxymethyl)-5,7-dihydroindolo[2,3-b]carbazole-2-carboxylate
• SMILES: CCN(CC)CCOc1c2[nH]c3ccc(COC=O)cc3c2cc2c1[nH]c1ccc(C(=O)OC)cc12.CN(C)CCOc1c2[nH]c3ccc(F)cc3c2c(C(F)(F)F)c2c1[nH]c1ccc(F)cc12.NC(=O)NCc1c2[nH]c3ccc(F)cc3c2cc2c1[nH]c1ccc(F)cc12.NC(=O)c1c2[nH]c3ccc(F)cc3c2cc2c1[nH]c1ccc(F)cc12
• InChI: InChI=1S/C28H29N3O5.C23H18F5N3O.C20H14F2N4O.C19H11F2N3O/c1-4-31(5-2)10-11-36-27-25-21(19-12-17(15-35-16-32)6-8-23(19)29-25)14-22-20-13-18(28(33)34-3)7-9-24(20)30-26(22)27;1-31(2)7-8-32-22-20-17(13-9-11(24)3-5-15(13)29-20)19(23(26,27)28)18-14-10-12(25)4-6-16(14)30-21(18)22;21-9-1-3-16-11(5-9)13-7-14-12-6-10(22)2-4-17(12)26-19(14)15(18(13)25-16)8-24-20(23)27;20-8-1-3-14-10(5-8)12-7-13-11-6-9(21)2-4-15(11)24-18(13)16(19(22)25)17(12)23-14/h6-9,12-14,16,29-30H,4-5,10-11,15H2,1-3H3;3-6,9-10,29-30H,7-8H2,1-2H3;1-7,25-26H,8H2,(H3,23,24,27);1-7,23-24H,(H2,22,25)
• InChIKey: KTBBLLVOBCYSHH-UHFFFAOYSA-N
• XLogP: 20.06
• TPSA: 302.07 Ų
• H-Bond Donors: 11
• H-Bond Acceptors: 10
• Rotatable Bonds: 17
• Heavy Atoms: 120
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1634.63
LogP ≤ 5	20.06
H-Bond Donors ≤ 5	11
H-Bond Acceptors ≤ 10	10

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'aldehyde', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazole-6-carboxamide;(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)methylurea;2-[[2,10-difluoro-12-(trifluoromethyl)-5,7-dihydroindolo[2,3-b]carbazol-6-yl]oxy]-N,N-dimethylethanamine;methyl 6-[2-(diethylamino)ethoxy]-10-(formyloxymethyl)-5,7-dihydroindolo[2,3-b]carbazole-2-carboxylate?

The IUPAC name of 2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazole-6-carboxamide;(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)methylurea;2-[[2,10-difluoro-12-(trifluoromethyl)-5,7-dihydroindolo[2,3-b]carbazol-6-yl]oxy]-N,N-dimethylethanamine;methyl 6-[2-(diethylamino)ethoxy]-10-(formyloxymethyl)-5,7-dihydroindolo[2,3-b]carbazole-2-carboxylate (CID 159232267) is 2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazole-6-carboxamide;(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)methylurea;2-[[2,10-difluoro-12-(trifluoromethyl)-5,7-dihydroindolo[2,3-b]carbazol-6-yl]oxy]-N,N-dimethylethanamine;methyl 6-[2-(diethylamino)ethoxy]-10-(formyloxymethyl)-5,7-dihydroindolo[2,3-b]carbazole-2-carboxylate.

What is the SMILES notation for 2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazole-6-carboxamide;(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)methylurea;2-[[2,10-difluoro-12-(trifluoromethyl)-5,7-dihydroindolo[2,3-b]carbazol-6-yl]oxy]-N,N-dimethylethanamine;methyl 6-[2-(diethylamino)ethoxy]-10-(formyloxymethyl)-5,7-dihydroindolo[2,3-b]carbazole-2-carboxylate?

The canonical SMILES for 2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazole-6-carboxamide;(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)methylurea;2-[[2,10-difluoro-12-(trifluoromethyl)-5,7-dihydroindolo[2,3-b]carbazol-6-yl]oxy]-N,N-dimethylethanamine;methyl 6-[2-(diethylamino)ethoxy]-10-(formyloxymethyl)-5,7-dihydroindolo[2,3-b]carbazole-2-carboxylate is CCN(CC)CCOc1c2[nH]c3ccc(COC=O)cc3c2cc2c1[nH]c1ccc(C(=O)OC)cc12.CN(C)CCOc1c2[nH]c3ccc(F)cc3c2c(C(F)(F)F)c2c1[nH]c1ccc(F)cc12.NC(=O)NCc1c2[nH]c3ccc(F)cc3c2cc2c1[nH]c1ccc(F)cc12.NC(=O)c1c2[nH]c3ccc(F)cc3c2cc2c1[nH]c1ccc(F)cc12.

What is the InChIKey of 2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazole-6-carboxamide;(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)methylurea;2-[[2,10-difluoro-12-(trifluoromethyl)-5,7-dihydroindolo[2,3-b]carbazol-6-yl]oxy]-N,N-dimethylethanamine;methyl 6-[2-(diethylamino)ethoxy]-10-(formyloxymethyl)-5,7-dihydroindolo[2,3-b]carbazole-2-carboxylate?

The InChIKey is KTBBLLVOBCYSHH-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H29N3O5.C23H18F5N3O.C20H14F2N4O.C19H11F2N3O/c1-4-31(5-2)10-11-36-27-25-21(19-12-17(15-35-16-32)6-8-23(19)29-25)14-22-20-13-18(28(33)34-3)7-9-24(20)30-26(22)27;1-31(2)7-8-32-22-20-17(13-9-11(24)3-5-15(13)29-20)19(23(26,27)28)18-14-10-12(25)4-6-16(14)30-21(18)22;21-9-1-3-16-11(5-9)13-7-14-12-6-10(22)2-4-17(12)26-19(14)15(18(13)25-16)8-24-20(23)27;20-8-1-3-14-10(5-8)12-7-13-11-6-9(21)2-4-15(11)24-18(13)16(19(22)25)17(12)23-14/h6-9,12-14,16,29-30H,4-5,10-11,15H2,1-3H3;3-6,9-10,29-30H,7-8H2,1-2H3;1-7,25-26H,8H2,(H3,23,24,27);1-7,23-24H,(H2,22,25).

What are the key properties of 2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazole-6-carboxamide;(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)methylurea;2-[[2,10-difluoro-12-(trifluoromethyl)-5,7-dihydroindolo[2,3-b]carbazol-6-yl]oxy]-N,N-dimethylethanamine;methyl 6-[2-(diethylamino)ethoxy]-10-(formyloxymethyl)-5,7-dihydroindolo[2,3-b]carbazole-2-carboxylate?

2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazole-6-carboxamide;(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)methylurea;2-[[2,10-difluoro-12-(trifluoromethyl)-5,7-dihydroindolo[2,3-b]carbazol-6-yl]oxy]-N,N-dimethylethanamine;methyl 6-[2-(diethylamino)ethoxy]-10-(formyloxymethyl)-5,7-dihydroindolo[2,3-b]carbazole-2-carboxylate has a molecular weight of 1634.63 g/mol, XLogP of 20.06, 17 rotatable bonds, 11 hydrogen bond donors, and 10 hydrogen bond acceptors.

Where does this data come from?

All data for 2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazole-6-carboxamide;(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)methylurea;2-[[2,10-difluoro-12-(trifluoromethyl)-5,7-dihydroindolo[2,3-b]carbazol-6-yl]oxy]-N,N-dimethylethanamine;methyl 6-[2-(diethylamino)ethoxy]-10-(formyloxymethyl)-5,7-dihydroindolo[2,3-b]carbazole-2-carboxylate is sourced from PubChem (CID 159232267), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).