4-[(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)oxy]-N,N-dimethylbutanimidamide;4-[(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)oxy]-N'-propan-2-ylbutanimidamide;N'-[3-[(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)oxy]propyl]benzenecarboximidamide;N'-[3-[(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)oxy]propyl]ethanimidamide;2,10-difluoro-6-methoxy-5,7-dihydroindolo[2,3-b]carbazole-12-carbonitrile

C120H99F10N19O5 — CID 157090945

IUPAC4-[(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)oxy]-N,N-dimethylbutanimidamide;4-[(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)oxy]-N'-propan-2-ylbutanimidamide;N'-[3-[(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)oxy]propyl]benzenecarboximidamide;N'-[3-[(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)oxy]propyl]ethanimidamide;2,10-difluoro-6-methoxy-5,7-dihydroindolo[2,3-b]carbazole-12-carbonitrile
SMILESC/C(N)=N\CCCOc1c2[nH]c3ccc(F)cc3c2cc2c1[nH]c1ccc(F)cc12.CC(C)/N=C(\N)CCCOc1c2[nH]c3ccc(F)cc3c2cc2c1[nH]c1ccc(F)cc12.COc1c2[nH]c3ccc(F)cc3c2c(C#N)c2c1[nH]c1ccc(F)cc12.N/C(=N\CCCOc1c2[nH]c3ccc(F)cc3c2cc2c1[nH]c1ccc(F)cc12)c1ccccc1.[H]/N=C(/CCCOc1c2[nH]c3ccc(F)cc3c2cc2c1[nH]c1ccc(F)cc12)N(C)C
InChIInChI=1S/C28H22F2N4O.C25H24F2N4O.C24H22F2N4O.C23H20F2N4O.C20H11F2N3O/c29-17-7-9-23-19(13-17)21-15-22-20-14-18(30)8-10-24(20)34-26(22)27(25(21)33-23)35-12-4-11-32-28(31)16-5-2-1-3-6-16;1-13(2)29-22(28)4-3-9-32-25-23-18(16-10-14(26)5-7-20(16)30-23)12-19-17-11-15(27)6-8-21(17)31-24(19)25;1-30(2)21(27)4-3-9-31-24-22-17(15-10-13(25)5-7-19(15)28-22)12-18-16-11-14(26)6-8-20(16)29-23(18)24;1-12(26)27-7-2-8-30-23-21-17(15-9-13(24)3-5-19(15)28-21)11-18-16-10-14(25)4-6-20(16)29-22(18)23;1-26-20-18-16(11-6-9(21)2-4-14(11)24-18)13(8-23)17-12-7-10(22)3-5-15(12)25-19(17)20/h1-3,5-10,13-15,33-34H,4,11-12H2,(H2,31,32);5-8,10-13,30-31H,3-4,9H2,1-2H3,(H2,28,29);5-8,10-12,27-29H,3-4,9H2,1-2H3;3-6,9-11,28-29H,2,7-8H2,1H3,(H2,26,27);2-7,24-25H,1H3/b;;27-21-;;
InChIKeyAEQQBPHYHMZCCC-VYSNIHNLSA-N
MW2077.22 g/mol
LogP28.99
Rot. Bonds23

About 4-[(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)oxy]-N,N-dimethylbutanimidamide;4-[(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)oxy]-N'-propan-2-ylbutanimidamide;N'-[3-[(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)oxy]propyl]benzenecarboximidamide;N'-[3-[(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)oxy]propyl]ethanimidamide;2,10-difluoro-6-methoxy-5,7-dihydroindolo[2,3-b]carbazole-12-carbonitrile

4-[(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)oxy]-N,N-dimethylbutanimidamide;4-[(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)oxy]-N'-propan-2-ylbutanimidamide;N'-[3-[(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)oxy]propyl]benzenecarboximidamide;N'-[3-[(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)oxy]propyl]ethanimidamide;2,10-difluoro-6-methoxy-5,7-dihydroindolo[2,3-b]carbazole-12-carbonitrile (PubChem CID 157090945) has the molecular formula C120H99F10N19O5 and a molecular weight of 2077.22 g/mol. Its IUPAC name is 4-[(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)oxy]-N,N-dimethylbutanimidamide;4-[(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)oxy]-N'-propan-2-ylbutanimidamide;N'-[3-[(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)oxy]propyl]benzenecarboximidamide;N'-[3-[(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)oxy]propyl]ethanimidamide;2,10-difluoro-6-methoxy-5,7-dihydroindolo[2,3-b]carbazole-12-carbonitrile.

Molecular Properties

Compound Name4-[(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)oxy]-N,N-dimethylbutanimidamide;4-[(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)oxy]-N'-propan-2-ylbutanimidamide;N'-[3-[(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)oxy]propyl]benzenecarboximidamide;N'-[3-[(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)oxy]propyl]ethanimidamide;2,10-difluoro-6-methoxy-5,7-dihydroindolo[2,3-b]carbazole-12-carbonitrile
PubChem CID157090945
Molecular FormulaC120H99F10N19O5
Molecular Weight2077.22 g/mol
Exact Mass2075.79
IUPAC Name4-[(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)oxy]-N,N-dimethylbutanimidamide;4-[(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)oxy]-N'-propan-2-ylbutanimidamide;N'-[3-[(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)oxy]propyl]benzenecarboximidamide;N'-[3-[(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)oxy]propyl]ethanimidamide;2,10-difluoro-6-methoxy-5,7-dihydroindolo[2,3-b]carbazole-12-carbonitrile
SMILESC/C(N)=N\CCCOc1c2[nH]c3ccc(F)cc3c2cc2c1[nH]c1ccc(F)cc12.CC(C)/N=C(\N)CCCOc1c2[nH]c3ccc(F)cc3c2cc2c1[nH]c1ccc(F)cc12.COc1c2[nH]c3ccc(F)cc3c2c(C#N)c2c1[nH]c1ccc(F)cc12.N/C(=N\CCCOc1c2[nH]c3ccc(F)cc3c2cc2c1[nH]c1ccc(F)cc12)c1ccccc1.[H]/N=C(/CCCOc1c2[nH]c3ccc(F)cc3c2cc2c1[nH]c1ccc(F)cc12)N(C)C
InChIInChI=1S/C28H22F2N4O.C25H24F2N4O.C24H22F2N4O.C23H20F2N4O.C20H11F2N3O/c29-17-7-9-23-19(13-17)21-15-22-20-14-18(30)8-10-24(20)34-26(22)27(25(21)33-23)35-12-4-11-32-28(31)16-5-2-1-3-6-16;1-13(2)29-22(28)4-3-9-32-25-23-18(16-10-14(26)5-7-20(16)30-23)12-19-17-11-15(27)6-8-21(17)31-24(19)25;1-30(2)21(27)4-3-9-31-24-22-17(15-10-13(25)5-7-19(15)28-22)12-18-16-11-14(26)6-8-20(16)29-23(18)24;1-12(26)27-7-2-8-30-23-21-17(15-9-13(24)3-5-19(15)28-21)11-18-16-10-14(25)4-6-20(16)29-22(18)23;1-26-20-18-16(11-6-9(21)2-4-14(11)24-18)13(8-23)17-12-7-10(22)3-5-15(12)25-19(17)20/h1-3,5-10,13-15,33-34H,4,11-12H2,(H2,31,32);5-8,10-13,30-31H,3-4,9H2,1-2H3,(H2,28,29);5-8,10-12,27-29H,3-4,9H2,1-2H3;3-6,9-11,28-29H,2,7-8H2,1H3,(H2,26,27);2-7,24-25H,1H3/b;;27-21-;;
InChIKeyAEQQBPHYHMZCCC-VYSNIHNLSA-N
XLogP28.99
TPSA370.07 Ų
H-Bond Donors14
H-Bond Acceptors10
Rotatable Bonds23
Heavy Atoms154
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002077.22
LogP ≤ 528.99
H-Bond Donors ≤ 514
H-Bond Acceptors ≤ 1010

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

Analyze 4-[(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)oxy]-N,N-dimethylbutanimidamide;4-[(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)oxy]-N'-propan-2-ylbutanimidamide;N'-[3-[(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)oxy]propyl]benzenecarboximidamide;N'-[3-[(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)oxy]propyl]ethanimidamide;2,10-difluoro-6-methoxy-5,7-dihydroindolo[2,3-b]carbazole-12-carbonitrile with MolForge

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Frequently Asked Questions

What is the IUPAC name of 4-[(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)oxy]-N,N-dimethylbutanimidamide;4-[(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)oxy]-N'-propan-2-ylbutanimidamide;N'-[3-[(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)oxy]propyl]benzenecarboximidamide;N'-[3-[(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)oxy]propyl]ethanimidamide;2,10-difluoro-6-methoxy-5,7-dihydroindolo[2,3-b]carbazole-12-carbonitrile?
The IUPAC name of 4-[(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)oxy]-N,N-dimethylbutanimidamide;4-[(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)oxy]-N'-propan-2-ylbutanimidamide;N'-[3-[(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)oxy]propyl]benzenecarboximidamide;N'-[3-[(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)oxy]propyl]ethanimidamide;2,10-difluoro-6-methoxy-5,7-dihydroindolo[2,3-b]carbazole-12-carbonitrile (CID 157090945) is 4-[(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)oxy]-N,N-dimethylbutanimidamide;4-[(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)oxy]-N'-propan-2-ylbutanimidamide;N'-[3-[(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)oxy]propyl]benzenecarboximidamide;N'-[3-[(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)oxy]propyl]ethanimidamide;2,10-difluoro-6-methoxy-5,7-dihydroindolo[2,3-b]carbazole-12-carbonitrile.
What is the SMILES notation for 4-[(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)oxy]-N,N-dimethylbutanimidamide;4-[(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)oxy]-N'-propan-2-ylbutanimidamide;N'-[3-[(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)oxy]propyl]benzenecarboximidamide;N'-[3-[(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)oxy]propyl]ethanimidamide;2,10-difluoro-6-methoxy-5,7-dihydroindolo[2,3-b]carbazole-12-carbonitrile?
The canonical SMILES for 4-[(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)oxy]-N,N-dimethylbutanimidamide;4-[(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)oxy]-N'-propan-2-ylbutanimidamide;N'-[3-[(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)oxy]propyl]benzenecarboximidamide;N'-[3-[(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)oxy]propyl]ethanimidamide;2,10-difluoro-6-methoxy-5,7-dihydroindolo[2,3-b]carbazole-12-carbonitrile is C/C(N)=N\CCCOc1c2[nH]c3ccc(F)cc3c2cc2c1[nH]c1ccc(F)cc12.CC(C)/N=C(\N)CCCOc1c2[nH]c3ccc(F)cc3c2cc2c1[nH]c1ccc(F)cc12.COc1c2[nH]c3ccc(F)cc3c2c(C#N)c2c1[nH]c1ccc(F)cc12.N/C(=N\CCCOc1c2[nH]c3ccc(F)cc3c2cc2c1[nH]c1ccc(F)cc12)c1ccccc1.[H]/N=C(/CCCOc1c2[nH]c3ccc(F)cc3c2cc2c1[nH]c1ccc(F)cc12)N(C)C.
What is the InChIKey of 4-[(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)oxy]-N,N-dimethylbutanimidamide;4-[(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)oxy]-N'-propan-2-ylbutanimidamide;N'-[3-[(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)oxy]propyl]benzenecarboximidamide;N'-[3-[(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)oxy]propyl]ethanimidamide;2,10-difluoro-6-methoxy-5,7-dihydroindolo[2,3-b]carbazole-12-carbonitrile?
The InChIKey is AEQQBPHYHMZCCC-VYSNIHNLSA-N. The full InChI is InChI=1S/C28H22F2N4O.C25H24F2N4O.C24H22F2N4O.C23H20F2N4O.C20H11F2N3O/c29-17-7-9-23-19(13-17)21-15-22-20-14-18(30)8-10-24(20)34-26(22)27(25(21)33-23)35-12-4-11-32-28(31)16-5-2-1-3-6-16;1-13(2)29-22(28)4-3-9-32-25-23-18(16-10-14(26)5-7-20(16)30-23)12-19-17-11-15(27)6-8-21(17)31-24(19)25;1-30(2)21(27)4-3-9-31-24-22-17(15-10-13(25)5-7-19(15)28-22)12-18-16-11-14(26)6-8-20(16)29-23(18)24;1-12(26)27-7-2-8-30-23-21-17(15-9-13(24)3-5-19(15)28-21)11-18-16-10-14(25)4-6-20(16)29-22(18)23;1-26-20-18-16(11-6-9(21)2-4-14(11)24-18)13(8-23)17-12-7-10(22)3-5-15(12)25-19(17)20/h1-3,5-10,13-15,33-34H,4,11-12H2,(H2,31,32);5-8,10-13,30-31H,3-4,9H2,1-2H3,(H2,28,29);5-8,10-12,27-29H,3-4,9H2,1-2H3;3-6,9-11,28-29H,2,7-8H2,1H3,(H2,26,27);2-7,24-25H,1H3/b;;27-21-;;.
What are the key properties of 4-[(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)oxy]-N,N-dimethylbutanimidamide;4-[(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)oxy]-N'-propan-2-ylbutanimidamide;N'-[3-[(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)oxy]propyl]benzenecarboximidamide;N'-[3-[(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)oxy]propyl]ethanimidamide;2,10-difluoro-6-methoxy-5,7-dihydroindolo[2,3-b]carbazole-12-carbonitrile?
4-[(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)oxy]-N,N-dimethylbutanimidamide;4-[(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)oxy]-N'-propan-2-ylbutanimidamide;N'-[3-[(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)oxy]propyl]benzenecarboximidamide;N'-[3-[(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)oxy]propyl]ethanimidamide;2,10-difluoro-6-methoxy-5,7-dihydroindolo[2,3-b]carbazole-12-carbonitrile has a molecular weight of 2077.22 g/mol, XLogP of 28.99, 23 rotatable bonds, 14 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)oxy]-N,N-dimethylbutanimidamide;4-[(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)oxy]-N'-propan-2-ylbutanimidamide;N'-[3-[(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)oxy]propyl]benzenecarboximidamide;N'-[3-[(2,10-difluoro-5,7-dihydroindolo[2,3-b]carbazol-6-yl)oxy]propyl]ethanimidamide;2,10-difluoro-6-methoxy-5,7-dihydroindolo[2,3-b]carbazole-12-carbonitrile is sourced from PubChem (CID 157090945), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).