6-chloro-3-(3,3-dimethyl-1,2-dihydroinden-2-yl)-1H-indole;3-(3,3-dimethyl-1,2-dihydroindol-2-yl)-7-methyl-1H-indole;2-(7-ethyl-1H-indol-3-yl)quinoline;2-(1H-indol-3-yl)-3,3-dimethyl-1,2-dihydroindole;2-(1H-indol-3-yl)-3,3-dimethylindole;2-(1H-indol-3-yl)spiro[1,2-dihydroindole-3,1'-cyclohexane];2-(7-methoxy-1H-indol-3-yl)-4-methylquinoline;2-(2-methyl-1H-indol-3-yl)quinoline;2-(6-methyl-1H-indol-3-yl)quinoline;2-(7-methyl-1H-indol-3-yl)quinoline

C187H168ClN19O — CID 159678041

IUPAC6-chloro-3-(3,3-dimethyl-1,2-dihydroinden-2-yl)-1H-indole;3-(3,3-dimethyl-1,2-dihydroindol-2-yl)-7-methyl-1H-indole;2-(7-ethyl-1H-indol-3-yl)quinoline;2-(1H-indol-3-yl)-3,3-dimethyl-1,2-dihydroindole;2-(1H-indol-3-yl)-3,3-dimethylindole;2-(1H-indol-3-yl)spiro[1,2-dihydroindole-3,1'-cyclohexane];2-(7-methoxy-1H-indol-3-yl)-4-methylquinoline;2-(2-methyl-1H-indol-3-yl)quinoline;2-(6-methyl-1H-indol-3-yl)quinoline;2-(7-methyl-1H-indol-3-yl)quinoline
SMILESCC1(C)C(c2c[nH]c3ccccc23)=Nc2ccccc21.CC1(C)c2ccccc2CC1c1c[nH]c2cc(Cl)ccc12.CC1(C)c2ccccc2NC1c1c[nH]c2ccccc12.CCc1cccc2c(-c3ccc4ccccc4n3)c[nH]c12.COc1cccc2c(-c3cc(C)c4ccccc4n3)c[nH]c12.Cc1[nH]c2ccccc2c1-c1ccc2ccccc2n1.Cc1ccc2c(-c3ccc4ccccc4n3)c[nH]c2c1.Cc1cccc2c(-c3ccc4ccccc4n3)c[nH]c12.Cc1cccc2c(C3Nc4ccccc4C3(C)C)c[nH]c12.c1ccc2c(c1)NC(c1c[nH]c3ccccc13)C21CCCCC1
InChIInChI=1S/C21H22N2.C19H18ClN.C19H16N2O.C19H20N2.C19H16N2.C18H18N2.C18H16N2.3C18H14N2/c1-6-12-21(13-7-1)17-9-3-5-11-19(17)23-20(21)16-14-22-18-10-4-2-8-15(16)18;1-19(2)16-6-4-3-5-12(16)9-17(19)15-11-21-18-10-13(20)7-8-14(15)18;1-12-10-17(21-16-8-4-3-6-13(12)16)15-11-20-19-14(15)7-5-9-18(19)22-2;1-12-7-6-8-13-14(11-20-17(12)13)18-19(2,3)15-9-4-5-10-16(15)21-18;1-2-13-7-5-8-15-16(12-20-19(13)15)18-11-10-14-6-3-4-9-17(14)21-18;2*1-18(2)14-8-4-6-10-16(14)20-17(18)13-11-19-15-9-5-3-7-12(13)15;1-12-18(14-7-3-5-9-16(14)19-12)17-11-10-13-6-2-4-8-15(13)20-17;1-12-5-4-7-14-15(11-19-18(12)14)17-10-9-13-6-2-3-8-16(13)20-17;1-12-6-8-14-15(11-19-18(14)10-12)17-9-7-13-4-2-3-5-16(13)20-17/h2-5,8-11,14,20,22-23H,1,6-7,12-13H2;3-8,10-11,17,21H,9H2,1-2H3;3-11,20H,1-2H3;4-11,18,20-21H,1-3H3;3-12,20H,2H2,1H3;3-11,17,19-20H,1-2H3;3-11,19H,1-2H3;3*2-11,19H,1H3
InChIKeyMUVZVCKQVDQTET-UHFFFAOYSA-N
MW2732.99 g/mol
LogP48.81
Rot. Bonds12

About 6-chloro-3-(3,3-dimethyl-1,2-dihydroinden-2-yl)-1H-indole;3-(3,3-dimethyl-1,2-dihydroindol-2-yl)-7-methyl-1H-indole;2-(7-ethyl-1H-indol-3-yl)quinoline;2-(1H-indol-3-yl)-3,3-dimethyl-1,2-dihydroindole;2-(1H-indol-3-yl)-3,3-dimethylindole;2-(1H-indol-3-yl)spiro[1,2-dihydroindole-3,1'-cyclohexane];2-(7-methoxy-1H-indol-3-yl)-4-methylquinoline;2-(2-methyl-1H-indol-3-yl)quinoline;2-(6-methyl-1H-indol-3-yl)quinoline;2-(7-methyl-1H-indol-3-yl)quinoline

6-chloro-3-(3,3-dimethyl-1,2-dihydroinden-2-yl)-1H-indole;3-(3,3-dimethyl-1,2-dihydroindol-2-yl)-7-methyl-1H-indole;2-(7-ethyl-1H-indol-3-yl)quinoline;2-(1H-indol-3-yl)-3,3-dimethyl-1,2-dihydroindole;2-(1H-indol-3-yl)-3,3-dimethylindole;2-(1H-indol-3-yl)spiro[1,2-dihydroindole-3,1'-cyclohexane];2-(7-methoxy-1H-indol-3-yl)-4-methylquinoline;2-(2-methyl-1H-indol-3-yl)quinoline;2-(6-methyl-1H-indol-3-yl)quinoline;2-(7-methyl-1H-indol-3-yl)quinoline (PubChem CID 159678041) has the molecular formula C187H168ClN19O and a molecular weight of 2732.99 g/mol. Its IUPAC name is 6-chloro-3-(3,3-dimethyl-1,2-dihydroinden-2-yl)-1H-indole;3-(3,3-dimethyl-1,2-dihydroindol-2-yl)-7-methyl-1H-indole;2-(7-ethyl-1H-indol-3-yl)quinoline;2-(1H-indol-3-yl)-3,3-dimethyl-1,2-dihydroindole;2-(1H-indol-3-yl)-3,3-dimethylindole;2-(1H-indol-3-yl)spiro[1,2-dihydroindole-3,1'-cyclohexane];2-(7-methoxy-1H-indol-3-yl)-4-methylquinoline;2-(2-methyl-1H-indol-3-yl)quinoline;2-(6-methyl-1H-indol-3-yl)quinoline;2-(7-methyl-1H-indol-3-yl)quinoline.

Molecular Properties

Compound Name6-chloro-3-(3,3-dimethyl-1,2-dihydroinden-2-yl)-1H-indole;3-(3,3-dimethyl-1,2-dihydroindol-2-yl)-7-methyl-1H-indole;2-(7-ethyl-1H-indol-3-yl)quinoline;2-(1H-indol-3-yl)-3,3-dimethyl-1,2-dihydroindole;2-(1H-indol-3-yl)-3,3-dimethylindole;2-(1H-indol-3-yl)spiro[1,2-dihydroindole-3,1'-cyclohexane];2-(7-methoxy-1H-indol-3-yl)-4-methylquinoline;2-(2-methyl-1H-indol-3-yl)quinoline;2-(6-methyl-1H-indol-3-yl)quinoline;2-(7-methyl-1H-indol-3-yl)quinoline
PubChem CID159678041
Molecular FormulaC187H168ClN19O
Molecular Weight2732.99 g/mol
Exact Mass2730.34
IUPAC Name6-chloro-3-(3,3-dimethyl-1,2-dihydroinden-2-yl)-1H-indole;3-(3,3-dimethyl-1,2-dihydroindol-2-yl)-7-methyl-1H-indole;2-(7-ethyl-1H-indol-3-yl)quinoline;2-(1H-indol-3-yl)-3,3-dimethyl-1,2-dihydroindole;2-(1H-indol-3-yl)-3,3-dimethylindole;2-(1H-indol-3-yl)spiro[1,2-dihydroindole-3,1'-cyclohexane];2-(7-methoxy-1H-indol-3-yl)-4-methylquinoline;2-(2-methyl-1H-indol-3-yl)quinoline;2-(6-methyl-1H-indol-3-yl)quinoline;2-(7-methyl-1H-indol-3-yl)quinoline
SMILESCC1(C)C(c2c[nH]c3ccccc23)=Nc2ccccc21.CC1(C)c2ccccc2CC1c1c[nH]c2cc(Cl)ccc12.CC1(C)c2ccccc2NC1c1c[nH]c2ccccc12.CCc1cccc2c(-c3ccc4ccccc4n3)c[nH]c12.COc1cccc2c(-c3cc(C)c4ccccc4n3)c[nH]c12.Cc1[nH]c2ccccc2c1-c1ccc2ccccc2n1.Cc1ccc2c(-c3ccc4ccccc4n3)c[nH]c2c1.Cc1cccc2c(-c3ccc4ccccc4n3)c[nH]c12.Cc1cccc2c(C3Nc4ccccc4C3(C)C)c[nH]c12.c1ccc2c(c1)NC(c1c[nH]c3ccccc13)C21CCCCC1
InChIInChI=1S/C21H22N2.C19H18ClN.C19H16N2O.C19H20N2.C19H16N2.C18H18N2.C18H16N2.3C18H14N2/c1-6-12-21(13-7-1)17-9-3-5-11-19(17)23-20(21)16-14-22-18-10-4-2-8-15(16)18;1-19(2)16-6-4-3-5-12(16)9-17(19)15-11-21-18-10-13(20)7-8-14(15)18;1-12-10-17(21-16-8-4-3-6-13(12)16)15-11-20-19-14(15)7-5-9-18(19)22-2;1-12-7-6-8-13-14(11-20-17(12)13)18-19(2,3)15-9-4-5-10-16(15)21-18;1-2-13-7-5-8-15-16(12-20-19(13)15)18-11-10-14-6-3-4-9-17(14)21-18;2*1-18(2)14-8-4-6-10-16(14)20-17(18)13-11-19-15-9-5-3-7-12(13)15;1-12-18(14-7-3-5-9-16(14)19-12)17-11-10-13-6-2-4-8-15(13)20-17;1-12-5-4-7-14-15(11-19-18(12)14)17-10-9-13-6-2-3-8-16(13)20-17;1-12-6-8-14-15(11-19-18(14)10-12)17-9-7-13-4-2-3-5-16(13)20-17/h2-5,8-11,14,20,22-23H,1,6-7,12-13H2;3-8,10-11,17,21H,9H2,1-2H3;3-11,20H,1-2H3;4-11,18,20-21H,1-3H3;3-12,20H,2H2,1H3;3-11,17,19-20H,1-2H3;3-11,19H,1-2H3;3*2-11,19H,1H3
InChIKeyMUVZVCKQVDQTET-UHFFFAOYSA-N
XLogP48.81
TPSA280.03 Ų
H-Bond Donors13
H-Bond Acceptors10
Rotatable Bonds12
Heavy Atoms208
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002732.99
LogP ≤ 548.81
H-Bond Donors ≤ 513
H-Bond Acceptors ≤ 1010

Analyze 6-chloro-3-(3,3-dimethyl-1,2-dihydroinden-2-yl)-1H-indole;3-(3,3-dimethyl-1,2-dihydroindol-2-yl)-7-methyl-1H-indole;2-(7-ethyl-1H-indol-3-yl)quinoline;2-(1H-indol-3-yl)-3,3-dimethyl-1,2-dihydroindole;2-(1H-indol-3-yl)-3,3-dimethylindole;2-(1H-indol-3-yl)spiro[1,2-dihydroindole-3,1'-cyclohexane];2-(7-methoxy-1H-indol-3-yl)-4-methylquinoline;2-(2-methyl-1H-indol-3-yl)quinoline;2-(6-methyl-1H-indol-3-yl)quinoline;2-(7-methyl-1H-indol-3-yl)quinoline with MolForge

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Frequently Asked Questions

What is the IUPAC name of 6-chloro-3-(3,3-dimethyl-1,2-dihydroinden-2-yl)-1H-indole;3-(3,3-dimethyl-1,2-dihydroindol-2-yl)-7-methyl-1H-indole;2-(7-ethyl-1H-indol-3-yl)quinoline;2-(1H-indol-3-yl)-3,3-dimethyl-1,2-dihydroindole;2-(1H-indol-3-yl)-3,3-dimethylindole;2-(1H-indol-3-yl)spiro[1,2-dihydroindole-3,1'-cyclohexane];2-(7-methoxy-1H-indol-3-yl)-4-methylquinoline;2-(2-methyl-1H-indol-3-yl)quinoline;2-(6-methyl-1H-indol-3-yl)quinoline;2-(7-methyl-1H-indol-3-yl)quinoline?
The IUPAC name of 6-chloro-3-(3,3-dimethyl-1,2-dihydroinden-2-yl)-1H-indole;3-(3,3-dimethyl-1,2-dihydroindol-2-yl)-7-methyl-1H-indole;2-(7-ethyl-1H-indol-3-yl)quinoline;2-(1H-indol-3-yl)-3,3-dimethyl-1,2-dihydroindole;2-(1H-indol-3-yl)-3,3-dimethylindole;2-(1H-indol-3-yl)spiro[1,2-dihydroindole-3,1'-cyclohexane];2-(7-methoxy-1H-indol-3-yl)-4-methylquinoline;2-(2-methyl-1H-indol-3-yl)quinoline;2-(6-methyl-1H-indol-3-yl)quinoline;2-(7-methyl-1H-indol-3-yl)quinoline (CID 159678041) is 6-chloro-3-(3,3-dimethyl-1,2-dihydroinden-2-yl)-1H-indole;3-(3,3-dimethyl-1,2-dihydroindol-2-yl)-7-methyl-1H-indole;2-(7-ethyl-1H-indol-3-yl)quinoline;2-(1H-indol-3-yl)-3,3-dimethyl-1,2-dihydroindole;2-(1H-indol-3-yl)-3,3-dimethylindole;2-(1H-indol-3-yl)spiro[1,2-dihydroindole-3,1'-cyclohexane];2-(7-methoxy-1H-indol-3-yl)-4-methylquinoline;2-(2-methyl-1H-indol-3-yl)quinoline;2-(6-methyl-1H-indol-3-yl)quinoline;2-(7-methyl-1H-indol-3-yl)quinoline.
What is the SMILES notation for 6-chloro-3-(3,3-dimethyl-1,2-dihydroinden-2-yl)-1H-indole;3-(3,3-dimethyl-1,2-dihydroindol-2-yl)-7-methyl-1H-indole;2-(7-ethyl-1H-indol-3-yl)quinoline;2-(1H-indol-3-yl)-3,3-dimethyl-1,2-dihydroindole;2-(1H-indol-3-yl)-3,3-dimethylindole;2-(1H-indol-3-yl)spiro[1,2-dihydroindole-3,1'-cyclohexane];2-(7-methoxy-1H-indol-3-yl)-4-methylquinoline;2-(2-methyl-1H-indol-3-yl)quinoline;2-(6-methyl-1H-indol-3-yl)quinoline;2-(7-methyl-1H-indol-3-yl)quinoline?
The canonical SMILES for 6-chloro-3-(3,3-dimethyl-1,2-dihydroinden-2-yl)-1H-indole;3-(3,3-dimethyl-1,2-dihydroindol-2-yl)-7-methyl-1H-indole;2-(7-ethyl-1H-indol-3-yl)quinoline;2-(1H-indol-3-yl)-3,3-dimethyl-1,2-dihydroindole;2-(1H-indol-3-yl)-3,3-dimethylindole;2-(1H-indol-3-yl)spiro[1,2-dihydroindole-3,1'-cyclohexane];2-(7-methoxy-1H-indol-3-yl)-4-methylquinoline;2-(2-methyl-1H-indol-3-yl)quinoline;2-(6-methyl-1H-indol-3-yl)quinoline;2-(7-methyl-1H-indol-3-yl)quinoline is CC1(C)C(c2c[nH]c3ccccc23)=Nc2ccccc21.CC1(C)c2ccccc2CC1c1c[nH]c2cc(Cl)ccc12.CC1(C)c2ccccc2NC1c1c[nH]c2ccccc12.CCc1cccc2c(-c3ccc4ccccc4n3)c[nH]c12.COc1cccc2c(-c3cc(C)c4ccccc4n3)c[nH]c12.Cc1[nH]c2ccccc2c1-c1ccc2ccccc2n1.Cc1ccc2c(-c3ccc4ccccc4n3)c[nH]c2c1.Cc1cccc2c(-c3ccc4ccccc4n3)c[nH]c12.Cc1cccc2c(C3Nc4ccccc4C3(C)C)c[nH]c12.c1ccc2c(c1)NC(c1c[nH]c3ccccc13)C21CCCCC1.
What is the InChIKey of 6-chloro-3-(3,3-dimethyl-1,2-dihydroinden-2-yl)-1H-indole;3-(3,3-dimethyl-1,2-dihydroindol-2-yl)-7-methyl-1H-indole;2-(7-ethyl-1H-indol-3-yl)quinoline;2-(1H-indol-3-yl)-3,3-dimethyl-1,2-dihydroindole;2-(1H-indol-3-yl)-3,3-dimethylindole;2-(1H-indol-3-yl)spiro[1,2-dihydroindole-3,1'-cyclohexane];2-(7-methoxy-1H-indol-3-yl)-4-methylquinoline;2-(2-methyl-1H-indol-3-yl)quinoline;2-(6-methyl-1H-indol-3-yl)quinoline;2-(7-methyl-1H-indol-3-yl)quinoline?
The InChIKey is MUVZVCKQVDQTET-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H22N2.C19H18ClN.C19H16N2O.C19H20N2.C19H16N2.C18H18N2.C18H16N2.3C18H14N2/c1-6-12-21(13-7-1)17-9-3-5-11-19(17)23-20(21)16-14-22-18-10-4-2-8-15(16)18;1-19(2)16-6-4-3-5-12(16)9-17(19)15-11-21-18-10-13(20)7-8-14(15)18;1-12-10-17(21-16-8-4-3-6-13(12)16)15-11-20-19-14(15)7-5-9-18(19)22-2;1-12-7-6-8-13-14(11-20-17(12)13)18-19(2,3)15-9-4-5-10-16(15)21-18;1-2-13-7-5-8-15-16(12-20-19(13)15)18-11-10-14-6-3-4-9-17(14)21-18;2*1-18(2)14-8-4-6-10-16(14)20-17(18)13-11-19-15-9-5-3-7-12(13)15;1-12-18(14-7-3-5-9-16(14)19-12)17-11-10-13-6-2-4-8-15(13)20-17;1-12-5-4-7-14-15(11-19-18(12)14)17-10-9-13-6-2-3-8-16(13)20-17;1-12-6-8-14-15(11-19-18(14)10-12)17-9-7-13-4-2-3-5-16(13)20-17/h2-5,8-11,14,20,22-23H,1,6-7,12-13H2;3-8,10-11,17,21H,9H2,1-2H3;3-11,20H,1-2H3;4-11,18,20-21H,1-3H3;3-12,20H,2H2,1H3;3-11,17,19-20H,1-2H3;3-11,19H,1-2H3;3*2-11,19H,1H3.
What are the key properties of 6-chloro-3-(3,3-dimethyl-1,2-dihydroinden-2-yl)-1H-indole;3-(3,3-dimethyl-1,2-dihydroindol-2-yl)-7-methyl-1H-indole;2-(7-ethyl-1H-indol-3-yl)quinoline;2-(1H-indol-3-yl)-3,3-dimethyl-1,2-dihydroindole;2-(1H-indol-3-yl)-3,3-dimethylindole;2-(1H-indol-3-yl)spiro[1,2-dihydroindole-3,1'-cyclohexane];2-(7-methoxy-1H-indol-3-yl)-4-methylquinoline;2-(2-methyl-1H-indol-3-yl)quinoline;2-(6-methyl-1H-indol-3-yl)quinoline;2-(7-methyl-1H-indol-3-yl)quinoline?
6-chloro-3-(3,3-dimethyl-1,2-dihydroinden-2-yl)-1H-indole;3-(3,3-dimethyl-1,2-dihydroindol-2-yl)-7-methyl-1H-indole;2-(7-ethyl-1H-indol-3-yl)quinoline;2-(1H-indol-3-yl)-3,3-dimethyl-1,2-dihydroindole;2-(1H-indol-3-yl)-3,3-dimethylindole;2-(1H-indol-3-yl)spiro[1,2-dihydroindole-3,1'-cyclohexane];2-(7-methoxy-1H-indol-3-yl)-4-methylquinoline;2-(2-methyl-1H-indol-3-yl)quinoline;2-(6-methyl-1H-indol-3-yl)quinoline;2-(7-methyl-1H-indol-3-yl)quinoline has a molecular weight of 2732.99 g/mol, XLogP of 48.81, 12 rotatable bonds, 13 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-3-(3,3-dimethyl-1,2-dihydroinden-2-yl)-1H-indole;3-(3,3-dimethyl-1,2-dihydroindol-2-yl)-7-methyl-1H-indole;2-(7-ethyl-1H-indol-3-yl)quinoline;2-(1H-indol-3-yl)-3,3-dimethyl-1,2-dihydroindole;2-(1H-indol-3-yl)-3,3-dimethylindole;2-(1H-indol-3-yl)spiro[1,2-dihydroindole-3,1'-cyclohexane];2-(7-methoxy-1H-indol-3-yl)-4-methylquinoline;2-(2-methyl-1H-indol-3-yl)quinoline;2-(6-methyl-1H-indol-3-yl)quinoline;2-(7-methyl-1H-indol-3-yl)quinoline is sourced from PubChem (CID 159678041), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).