2-(7-chloro-1H-indol-3-yl)-7-methylquinoline;2-(5,7-difluoro-1H-indol-3-yl)-8-fluoroquinoline;2-(4,6-difluoro-5-methyl-3H-inden-1-yl)-N-methylquinoline-5-carboxamide;2-(5,7-difluoro-6-methyl-1H-indol-3-yl)quinoline;8-fluoro-2-(3H-inden-1-yl)quinoline;1-fluoro-7-(4-methyl-3H-inden-1-yl)naphthalene;2-(5-fluoro-7-methyl-1H-indol-3-yl)quinoline;2-(6-methyl-1H-indol-3-yl)quinoline;3-naphthalen-2-yl-1H-indazole

C165H116ClF10N15O — CID 159570222

IUPAC2-(7-chloro-1H-indol-3-yl)-7-methylquinoline;2-(5,7-difluoro-1H-indol-3-yl)-8-fluoroquinoline;2-(4,6-difluoro-5-methyl-3H-inden-1-yl)-N-methylquinoline-5-carboxamide;2-(5,7-difluoro-6-methyl-1H-indol-3-yl)quinoline;8-fluoro-2-(3H-inden-1-yl)quinoline;1-fluoro-7-(4-methyl-3H-inden-1-yl)naphthalene;2-(5-fluoro-7-methyl-1H-indol-3-yl)quinoline;2-(6-methyl-1H-indol-3-yl)quinoline;3-naphthalen-2-yl-1H-indazole
SMILESCNC(=O)c1cccc2nc(C3=CCc4c3cc(F)c(C)c4F)ccc12.Cc1c(F)cc2c(-c3ccc4ccccc4n3)c[nH]c2c1F.Cc1cc(F)cc2c(-c3ccc4ccccc4n3)c[nH]c12.Cc1ccc2c(-c3ccc4ccccc4n3)c[nH]c2c1.Cc1ccc2ccc(-c3c[nH]c4c(Cl)cccc34)nc2c1.Cc1cccc2c1CC=C2c1ccc2cccc(F)c2c1.Fc1cc(F)c2[nH]cc(-c3ccc4cccc(F)c4n3)c2c1.Fc1cccc2ccc(C3=CCc4ccccc43)nc12.c1ccc2cc(-c3n[nH]c4ccccc34)ccc2c1
InChIInChI=1S/C21H16F2N2O.C20H15F.C18H13ClN2.C18H12F2N2.C18H13FN2.C18H12FN.C18H14N2.C17H9F3N2.C17H12N2/c1-11-17(22)10-16-13(6-7-14(16)20(11)23)19-9-8-12-15(21(26)24-2)4-3-5-18(12)25-19;1-13-4-2-6-18-16(13)10-11-17(18)15-9-8-14-5-3-7-20(21)19(14)12-15;1-11-5-6-12-7-8-16(21-17(12)9-11)14-10-20-18-13(14)3-2-4-15(18)19;1-10-14(19)8-12-13(9-21-18(12)17(10)20)16-7-6-11-4-2-3-5-15(11)22-16;1-11-8-13(19)9-14-15(10-20-18(11)14)17-7-6-12-4-2-3-5-16(12)21-17;19-16-7-3-5-13-9-11-17(20-18(13)16)15-10-8-12-4-1-2-6-14(12)15;1-12-6-8-14-15(11-19-18(14)10-12)17-9-7-13-4-2-3-5-16(13)20-17;18-10-6-11-12(8-21-17(11)14(20)7-10)15-5-4-9-2-1-3-13(19)16(9)22-15;1-2-6-13-11-14(10-9-12(13)5-1)17-15-7-3-4-8-16(15)18-19-17/h3-6,8-10H,7H2,1-2H3,(H,24,26);2-9,11-12H,10H2,1H3;2-10,20H,1H3;2-9,21H,1H3;2-10,20H,1H3;1-7,9-11H,8H2;2-11,19H,1H3;1-8,21H;1-11H,(H,18,19)
InChIKeyMHSHWSFVLWLBOU-UHFFFAOYSA-N
MW2550.28 g/mol
LogP42.83
Rot. Bonds10

About 2-(7-chloro-1H-indol-3-yl)-7-methylquinoline;2-(5,7-difluoro-1H-indol-3-yl)-8-fluoroquinoline;2-(4,6-difluoro-5-methyl-3H-inden-1-yl)-N-methylquinoline-5-carboxamide;2-(5,7-difluoro-6-methyl-1H-indol-3-yl)quinoline;8-fluoro-2-(3H-inden-1-yl)quinoline;1-fluoro-7-(4-methyl-3H-inden-1-yl)naphthalene;2-(5-fluoro-7-methyl-1H-indol-3-yl)quinoline;2-(6-methyl-1H-indol-3-yl)quinoline;3-naphthalen-2-yl-1H-indazole

2-(7-chloro-1H-indol-3-yl)-7-methylquinoline;2-(5,7-difluoro-1H-indol-3-yl)-8-fluoroquinoline;2-(4,6-difluoro-5-methyl-3H-inden-1-yl)-N-methylquinoline-5-carboxamide;2-(5,7-difluoro-6-methyl-1H-indol-3-yl)quinoline;8-fluoro-2-(3H-inden-1-yl)quinoline;1-fluoro-7-(4-methyl-3H-inden-1-yl)naphthalene;2-(5-fluoro-7-methyl-1H-indol-3-yl)quinoline;2-(6-methyl-1H-indol-3-yl)quinoline;3-naphthalen-2-yl-1H-indazole (PubChem CID 159570222) has the molecular formula C165H116ClF10N15O and a molecular weight of 2550.28 g/mol. Its IUPAC name is 2-(7-chloro-1H-indol-3-yl)-7-methylquinoline;2-(5,7-difluoro-1H-indol-3-yl)-8-fluoroquinoline;2-(4,6-difluoro-5-methyl-3H-inden-1-yl)-N-methylquinoline-5-carboxamide;2-(5,7-difluoro-6-methyl-1H-indol-3-yl)quinoline;8-fluoro-2-(3H-inden-1-yl)quinoline;1-fluoro-7-(4-methyl-3H-inden-1-yl)naphthalene;2-(5-fluoro-7-methyl-1H-indol-3-yl)quinoline;2-(6-methyl-1H-indol-3-yl)quinoline;3-naphthalen-2-yl-1H-indazole.

Molecular Properties

Compound Name2-(7-chloro-1H-indol-3-yl)-7-methylquinoline;2-(5,7-difluoro-1H-indol-3-yl)-8-fluoroquinoline;2-(4,6-difluoro-5-methyl-3H-inden-1-yl)-N-methylquinoline-5-carboxamide;2-(5,7-difluoro-6-methyl-1H-indol-3-yl)quinoline;8-fluoro-2-(3H-inden-1-yl)quinoline;1-fluoro-7-(4-methyl-3H-inden-1-yl)naphthalene;2-(5-fluoro-7-methyl-1H-indol-3-yl)quinoline;2-(6-methyl-1H-indol-3-yl)quinoline;3-naphthalen-2-yl-1H-indazole
PubChem CID159570222
Molecular FormulaC165H116ClF10N15O
Molecular Weight2550.28 g/mol
Exact Mass2547.90
IUPAC Name2-(7-chloro-1H-indol-3-yl)-7-methylquinoline;2-(5,7-difluoro-1H-indol-3-yl)-8-fluoroquinoline;2-(4,6-difluoro-5-methyl-3H-inden-1-yl)-N-methylquinoline-5-carboxamide;2-(5,7-difluoro-6-methyl-1H-indol-3-yl)quinoline;8-fluoro-2-(3H-inden-1-yl)quinoline;1-fluoro-7-(4-methyl-3H-inden-1-yl)naphthalene;2-(5-fluoro-7-methyl-1H-indol-3-yl)quinoline;2-(6-methyl-1H-indol-3-yl)quinoline;3-naphthalen-2-yl-1H-indazole
SMILESCNC(=O)c1cccc2nc(C3=CCc4c3cc(F)c(C)c4F)ccc12.Cc1c(F)cc2c(-c3ccc4ccccc4n3)c[nH]c2c1F.Cc1cc(F)cc2c(-c3ccc4ccccc4n3)c[nH]c12.Cc1ccc2c(-c3ccc4ccccc4n3)c[nH]c2c1.Cc1ccc2ccc(-c3c[nH]c4c(Cl)cccc34)nc2c1.Cc1cccc2c1CC=C2c1ccc2cccc(F)c2c1.Fc1cc(F)c2[nH]cc(-c3ccc4cccc(F)c4n3)c2c1.Fc1cccc2ccc(C3=CCc4ccccc43)nc12.c1ccc2cc(-c3n[nH]c4ccccc34)ccc2c1
InChIInChI=1S/C21H16F2N2O.C20H15F.C18H13ClN2.C18H12F2N2.C18H13FN2.C18H12FN.C18H14N2.C17H9F3N2.C17H12N2/c1-11-17(22)10-16-13(6-7-14(16)20(11)23)19-9-8-12-15(21(26)24-2)4-3-5-18(12)25-19;1-13-4-2-6-18-16(13)10-11-17(18)15-9-8-14-5-3-7-20(21)19(14)12-15;1-11-5-6-12-7-8-16(21-17(12)9-11)14-10-20-18-13(14)3-2-4-15(18)19;1-10-14(19)8-12-13(9-21-18(12)17(10)20)16-7-6-11-4-2-3-5-15(11)22-16;1-11-8-13(19)9-14-15(10-20-18(11)14)17-7-6-12-4-2-3-5-16(12)21-17;19-16-7-3-5-13-9-11-17(20-18(13)16)15-10-8-12-4-1-2-6-14(12)15;1-12-6-8-14-15(11-19-18(14)10-12)17-9-7-13-4-2-3-5-16(13)20-17;18-10-6-11-12(8-21-17(11)14(20)7-10)15-5-4-9-2-1-3-13(19)16(9)22-15;1-2-6-13-11-14(10-9-12(13)5-1)17-15-7-3-4-8-16(15)18-19-17/h3-6,8-10H,7H2,1-2H3,(H,24,26);2-9,11-12H,10H2,1H3;2-10,20H,1H3;2-9,21H,1H3;2-10,20H,1H3;1-7,9-11H,8H2;2-11,19H,1H3;1-8,21H;1-11H,(H,18,19)
InChIKeyMHSHWSFVLWLBOU-UHFFFAOYSA-N
XLogP42.83
TPSA226.96 Ų
H-Bond Donors7
H-Bond Acceptors9
Rotatable Bonds10
Heavy Atoms192
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002550.28
LogP ≤ 542.83
H-Bond Donors ≤ 57
H-Bond Acceptors ≤ 109

Analyze 2-(7-chloro-1H-indol-3-yl)-7-methylquinoline;2-(5,7-difluoro-1H-indol-3-yl)-8-fluoroquinoline;2-(4,6-difluoro-5-methyl-3H-inden-1-yl)-N-methylquinoline-5-carboxamide;2-(5,7-difluoro-6-methyl-1H-indol-3-yl)quinoline;8-fluoro-2-(3H-inden-1-yl)quinoline;1-fluoro-7-(4-methyl-3H-inden-1-yl)naphthalene;2-(5-fluoro-7-methyl-1H-indol-3-yl)quinoline;2-(6-methyl-1H-indol-3-yl)quinoline;3-naphthalen-2-yl-1H-indazole with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2-(7-chloro-1H-indol-3-yl)-7-methylquinoline;2-(5,7-difluoro-1H-indol-3-yl)-8-fluoroquinoline;2-(4,6-difluoro-5-methyl-3H-inden-1-yl)-N-methylquinoline-5-carboxamide;2-(5,7-difluoro-6-methyl-1H-indol-3-yl)quinoline;8-fluoro-2-(3H-inden-1-yl)quinoline;1-fluoro-7-(4-methyl-3H-inden-1-yl)naphthalene;2-(5-fluoro-7-methyl-1H-indol-3-yl)quinoline;2-(6-methyl-1H-indol-3-yl)quinoline;3-naphthalen-2-yl-1H-indazole?
The IUPAC name of 2-(7-chloro-1H-indol-3-yl)-7-methylquinoline;2-(5,7-difluoro-1H-indol-3-yl)-8-fluoroquinoline;2-(4,6-difluoro-5-methyl-3H-inden-1-yl)-N-methylquinoline-5-carboxamide;2-(5,7-difluoro-6-methyl-1H-indol-3-yl)quinoline;8-fluoro-2-(3H-inden-1-yl)quinoline;1-fluoro-7-(4-methyl-3H-inden-1-yl)naphthalene;2-(5-fluoro-7-methyl-1H-indol-3-yl)quinoline;2-(6-methyl-1H-indol-3-yl)quinoline;3-naphthalen-2-yl-1H-indazole (CID 159570222) is 2-(7-chloro-1H-indol-3-yl)-7-methylquinoline;2-(5,7-difluoro-1H-indol-3-yl)-8-fluoroquinoline;2-(4,6-difluoro-5-methyl-3H-inden-1-yl)-N-methylquinoline-5-carboxamide;2-(5,7-difluoro-6-methyl-1H-indol-3-yl)quinoline;8-fluoro-2-(3H-inden-1-yl)quinoline;1-fluoro-7-(4-methyl-3H-inden-1-yl)naphthalene;2-(5-fluoro-7-methyl-1H-indol-3-yl)quinoline;2-(6-methyl-1H-indol-3-yl)quinoline;3-naphthalen-2-yl-1H-indazole.
What is the SMILES notation for 2-(7-chloro-1H-indol-3-yl)-7-methylquinoline;2-(5,7-difluoro-1H-indol-3-yl)-8-fluoroquinoline;2-(4,6-difluoro-5-methyl-3H-inden-1-yl)-N-methylquinoline-5-carboxamide;2-(5,7-difluoro-6-methyl-1H-indol-3-yl)quinoline;8-fluoro-2-(3H-inden-1-yl)quinoline;1-fluoro-7-(4-methyl-3H-inden-1-yl)naphthalene;2-(5-fluoro-7-methyl-1H-indol-3-yl)quinoline;2-(6-methyl-1H-indol-3-yl)quinoline;3-naphthalen-2-yl-1H-indazole?
The canonical SMILES for 2-(7-chloro-1H-indol-3-yl)-7-methylquinoline;2-(5,7-difluoro-1H-indol-3-yl)-8-fluoroquinoline;2-(4,6-difluoro-5-methyl-3H-inden-1-yl)-N-methylquinoline-5-carboxamide;2-(5,7-difluoro-6-methyl-1H-indol-3-yl)quinoline;8-fluoro-2-(3H-inden-1-yl)quinoline;1-fluoro-7-(4-methyl-3H-inden-1-yl)naphthalene;2-(5-fluoro-7-methyl-1H-indol-3-yl)quinoline;2-(6-methyl-1H-indol-3-yl)quinoline;3-naphthalen-2-yl-1H-indazole is CNC(=O)c1cccc2nc(C3=CCc4c3cc(F)c(C)c4F)ccc12.Cc1c(F)cc2c(-c3ccc4ccccc4n3)c[nH]c2c1F.Cc1cc(F)cc2c(-c3ccc4ccccc4n3)c[nH]c12.Cc1ccc2c(-c3ccc4ccccc4n3)c[nH]c2c1.Cc1ccc2ccc(-c3c[nH]c4c(Cl)cccc34)nc2c1.Cc1cccc2c1CC=C2c1ccc2cccc(F)c2c1.Fc1cc(F)c2[nH]cc(-c3ccc4cccc(F)c4n3)c2c1.Fc1cccc2ccc(C3=CCc4ccccc43)nc12.c1ccc2cc(-c3n[nH]c4ccccc34)ccc2c1.
What is the InChIKey of 2-(7-chloro-1H-indol-3-yl)-7-methylquinoline;2-(5,7-difluoro-1H-indol-3-yl)-8-fluoroquinoline;2-(4,6-difluoro-5-methyl-3H-inden-1-yl)-N-methylquinoline-5-carboxamide;2-(5,7-difluoro-6-methyl-1H-indol-3-yl)quinoline;8-fluoro-2-(3H-inden-1-yl)quinoline;1-fluoro-7-(4-methyl-3H-inden-1-yl)naphthalene;2-(5-fluoro-7-methyl-1H-indol-3-yl)quinoline;2-(6-methyl-1H-indol-3-yl)quinoline;3-naphthalen-2-yl-1H-indazole?
The InChIKey is MHSHWSFVLWLBOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H16F2N2O.C20H15F.C18H13ClN2.C18H12F2N2.C18H13FN2.C18H12FN.C18H14N2.C17H9F3N2.C17H12N2/c1-11-17(22)10-16-13(6-7-14(16)20(11)23)19-9-8-12-15(21(26)24-2)4-3-5-18(12)25-19;1-13-4-2-6-18-16(13)10-11-17(18)15-9-8-14-5-3-7-20(21)19(14)12-15;1-11-5-6-12-7-8-16(21-17(12)9-11)14-10-20-18-13(14)3-2-4-15(18)19;1-10-14(19)8-12-13(9-21-18(12)17(10)20)16-7-6-11-4-2-3-5-15(11)22-16;1-11-8-13(19)9-14-15(10-20-18(11)14)17-7-6-12-4-2-3-5-16(12)21-17;19-16-7-3-5-13-9-11-17(20-18(13)16)15-10-8-12-4-1-2-6-14(12)15;1-12-6-8-14-15(11-19-18(14)10-12)17-9-7-13-4-2-3-5-16(13)20-17;18-10-6-11-12(8-21-17(11)14(20)7-10)15-5-4-9-2-1-3-13(19)16(9)22-15;1-2-6-13-11-14(10-9-12(13)5-1)17-15-7-3-4-8-16(15)18-19-17/h3-6,8-10H,7H2,1-2H3,(H,24,26);2-9,11-12H,10H2,1H3;2-10,20H,1H3;2-9,21H,1H3;2-10,20H,1H3;1-7,9-11H,8H2;2-11,19H,1H3;1-8,21H;1-11H,(H,18,19).
What are the key properties of 2-(7-chloro-1H-indol-3-yl)-7-methylquinoline;2-(5,7-difluoro-1H-indol-3-yl)-8-fluoroquinoline;2-(4,6-difluoro-5-methyl-3H-inden-1-yl)-N-methylquinoline-5-carboxamide;2-(5,7-difluoro-6-methyl-1H-indol-3-yl)quinoline;8-fluoro-2-(3H-inden-1-yl)quinoline;1-fluoro-7-(4-methyl-3H-inden-1-yl)naphthalene;2-(5-fluoro-7-methyl-1H-indol-3-yl)quinoline;2-(6-methyl-1H-indol-3-yl)quinoline;3-naphthalen-2-yl-1H-indazole?
2-(7-chloro-1H-indol-3-yl)-7-methylquinoline;2-(5,7-difluoro-1H-indol-3-yl)-8-fluoroquinoline;2-(4,6-difluoro-5-methyl-3H-inden-1-yl)-N-methylquinoline-5-carboxamide;2-(5,7-difluoro-6-methyl-1H-indol-3-yl)quinoline;8-fluoro-2-(3H-inden-1-yl)quinoline;1-fluoro-7-(4-methyl-3H-inden-1-yl)naphthalene;2-(5-fluoro-7-methyl-1H-indol-3-yl)quinoline;2-(6-methyl-1H-indol-3-yl)quinoline;3-naphthalen-2-yl-1H-indazole has a molecular weight of 2550.28 g/mol, XLogP of 42.83, 10 rotatable bonds, 7 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(7-chloro-1H-indol-3-yl)-7-methylquinoline;2-(5,7-difluoro-1H-indol-3-yl)-8-fluoroquinoline;2-(4,6-difluoro-5-methyl-3H-inden-1-yl)-N-methylquinoline-5-carboxamide;2-(5,7-difluoro-6-methyl-1H-indol-3-yl)quinoline;8-fluoro-2-(3H-inden-1-yl)quinoline;1-fluoro-7-(4-methyl-3H-inden-1-yl)naphthalene;2-(5-fluoro-7-methyl-1H-indol-3-yl)quinoline;2-(6-methyl-1H-indol-3-yl)quinoline;3-naphthalen-2-yl-1H-indazole is sourced from PubChem (CID 159570222), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).