3-(3,3-dimethyl-1,2-dihydroinden-2-yl)-6-methyl-1H-indole;2-[5-(3,3-dimethyl-1,2-dihydroinden-2-yl)-1H-pyrrol-2-yl]-3,3-dimethyl-1,2-dihydroindole;3-(3,3-dimethyl-1,2-dihydroindol-2-yl)-5-methyl-1H-indole;3-(3,3-dimethyl-1,2-dihydroindol-2-yl)-7-methyl-1H-indole;3-(3,3-dimethyl-1,2-dihydroindol-2-yl)-1-[2-(3-methylphenoxy)ethyl]indole;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];methane;3-spiro[1,2-dihydroindole-3,1'-cyclohexane]-2-yl-1H-indol-7-ol;hydrochloride

C189H200ClN17O2 — CID 162191138

IUPAC3-(3,3-dimethyl-1,2-dihydroinden-2-yl)-6-methyl-1H-indole;2-[5-(3,3-dimethyl-1,2-dihydroinden-2-yl)-1H-pyrrol-2-yl]-3,3-dimethyl-1,2-dihydroindole;3-(3,3-dimethyl-1,2-dihydroindol-2-yl)-5-methyl-1H-indole;3-(3,3-dimethyl-1,2-dihydroindol-2-yl)-7-methyl-1H-indole;3-(3,3-dimethyl-1,2-dihydroindol-2-yl)-1-[2-(3-methylphenoxy)ethyl]indole;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];methane;3-spiro[1,2-dihydroindole-3,1'-cyclohexane]-2-yl-1H-indol-7-ol;hydrochloride
SMILESC.CC1(C)C(c2c[nH]c3ccccc23)=Nc2ccccc21.CC1(C)c2ccccc2CC1c1ccc(C2Nc3ccccc3C2(C)C)[nH]1.CC1(C)c2ccccc2NC1c1c[nH]c2ccccc12.Cc1ccc2[nH]cc(C3Nc4ccccc4C3(C)C)c2c1.Cc1ccc2c(C3Cc4ccccc4C3(C)C)c[nH]c2c1.Cc1cccc(OCCn2cc(C3Nc4ccccc4C3(C)C)c3ccccc32)c1.Cc1cccc2c(C3Nc4ccccc4C3(C)C)c[nH]c12.Cl.Oc1cccc2c(C3Nc4ccccc4C34CCCCC4)c[nH]c12.c1ccc2c(c1)NC(c1c[nH]c3ccccc13)C21CCCCC1
InChIInChI=1S/C27H28N2O.C25H28N2.C21H22N2O.C21H22N2.C20H21N.2C19H20N2.C18H18N2.C18H16N2.CH4.ClH/c1-19-9-8-10-20(17-19)30-16-15-29-18-22(21-11-4-7-14-25(21)29)26-27(2,3)23-12-5-6-13-24(23)28-26;1-24(2)17-10-6-5-9-16(17)15-19(24)21-13-14-22(26-21)23-25(3,4)18-11-7-8-12-20(18)27-23;24-18-10-6-7-14-15(13-22-19(14)18)20-21(11-4-1-5-12-21)16-8-2-3-9-17(16)23-20;1-6-12-21(13-7-1)17-9-3-5-11-19(17)23-20(21)16-14-22-18-10-4-2-8-15(16)18;1-13-8-9-15-16(12-21-19(15)10-13)18-11-14-6-4-5-7-17(14)20(18,2)3;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;1-12-8-9-16-13(10-12)14(11-20-16)18-19(2,3)15-6-4-5-7-17(15)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;;/h4-14,17-18,26,28H,15-16H2,1-3H3;5-14,19,23,26-27H,15H2,1-4H3;2-3,6-10,13,20,22-24H,1,4-5,11-12H2;2-5,8-11,14,20,22-23H,1,6-7,12-13H2;4-10,12,18,21H,11H2,1-3H3;2*4-11,18,20-21H,1-3H3;3-11,17,19-20H,1-2H3;3-11,19H,1-2H3;1H4;1H
InChIKeyFWTWFJFIZMZUJF-UHFFFAOYSA-N
MW2777.25 g/mol
LogP48.51
Rot. Bonds14

About 3-(3,3-dimethyl-1,2-dihydroinden-2-yl)-6-methyl-1H-indole;2-[5-(3,3-dimethyl-1,2-dihydroinden-2-yl)-1H-pyrrol-2-yl]-3,3-dimethyl-1,2-dihydroindole;3-(3,3-dimethyl-1,2-dihydroindol-2-yl)-5-methyl-1H-indole;3-(3,3-dimethyl-1,2-dihydroindol-2-yl)-7-methyl-1H-indole;3-(3,3-dimethyl-1,2-dihydroindol-2-yl)-1-[2-(3-methylphenoxy)ethyl]indole;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];methane;3-spiro[1,2-dihydroindole-3,1'-cyclohexane]-2-yl-1H-indol-7-ol;hydrochloride

3-(3,3-dimethyl-1,2-dihydroinden-2-yl)-6-methyl-1H-indole;2-[5-(3,3-dimethyl-1,2-dihydroinden-2-yl)-1H-pyrrol-2-yl]-3,3-dimethyl-1,2-dihydroindole;3-(3,3-dimethyl-1,2-dihydroindol-2-yl)-5-methyl-1H-indole;3-(3,3-dimethyl-1,2-dihydroindol-2-yl)-7-methyl-1H-indole;3-(3,3-dimethyl-1,2-dihydroindol-2-yl)-1-[2-(3-methylphenoxy)ethyl]indole;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];methane;3-spiro[1,2-dihydroindole-3,1'-cyclohexane]-2-yl-1H-indol-7-ol;hydrochloride (PubChem CID 162191138) has the molecular formula C189H200ClN17O2 and a molecular weight of 2777.25 g/mol. Its IUPAC name is 3-(3,3-dimethyl-1,2-dihydroinden-2-yl)-6-methyl-1H-indole;2-[5-(3,3-dimethyl-1,2-dihydroinden-2-yl)-1H-pyrrol-2-yl]-3,3-dimethyl-1,2-dihydroindole;3-(3,3-dimethyl-1,2-dihydroindol-2-yl)-5-methyl-1H-indole;3-(3,3-dimethyl-1,2-dihydroindol-2-yl)-7-methyl-1H-indole;3-(3,3-dimethyl-1,2-dihydroindol-2-yl)-1-[2-(3-methylphenoxy)ethyl]indole;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];methane;3-spiro[1,2-dihydroindole-3,1'-cyclohexane]-2-yl-1H-indol-7-ol;hydrochloride.

Molecular Properties

Compound Name3-(3,3-dimethyl-1,2-dihydroinden-2-yl)-6-methyl-1H-indole;2-[5-(3,3-dimethyl-1,2-dihydroinden-2-yl)-1H-pyrrol-2-yl]-3,3-dimethyl-1,2-dihydroindole;3-(3,3-dimethyl-1,2-dihydroindol-2-yl)-5-methyl-1H-indole;3-(3,3-dimethyl-1,2-dihydroindol-2-yl)-7-methyl-1H-indole;3-(3,3-dimethyl-1,2-dihydroindol-2-yl)-1-[2-(3-methylphenoxy)ethyl]indole;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];methane;3-spiro[1,2-dihydroindole-3,1'-cyclohexane]-2-yl-1H-indol-7-ol;hydrochloride
PubChem CID162191138
Molecular FormulaC189H200ClN17O2
Molecular Weight2777.25 g/mol
Exact Mass2774.58
IUPAC Name3-(3,3-dimethyl-1,2-dihydroinden-2-yl)-6-methyl-1H-indole;2-[5-(3,3-dimethyl-1,2-dihydroinden-2-yl)-1H-pyrrol-2-yl]-3,3-dimethyl-1,2-dihydroindole;3-(3,3-dimethyl-1,2-dihydroindol-2-yl)-5-methyl-1H-indole;3-(3,3-dimethyl-1,2-dihydroindol-2-yl)-7-methyl-1H-indole;3-(3,3-dimethyl-1,2-dihydroindol-2-yl)-1-[2-(3-methylphenoxy)ethyl]indole;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];methane;3-spiro[1,2-dihydroindole-3,1'-cyclohexane]-2-yl-1H-indol-7-ol;hydrochloride
SMILESC.CC1(C)C(c2c[nH]c3ccccc23)=Nc2ccccc21.CC1(C)c2ccccc2CC1c1ccc(C2Nc3ccccc3C2(C)C)[nH]1.CC1(C)c2ccccc2NC1c1c[nH]c2ccccc12.Cc1ccc2[nH]cc(C3Nc4ccccc4C3(C)C)c2c1.Cc1ccc2c(C3Cc4ccccc4C3(C)C)c[nH]c2c1.Cc1cccc(OCCn2cc(C3Nc4ccccc4C3(C)C)c3ccccc32)c1.Cc1cccc2c(C3Nc4ccccc4C3(C)C)c[nH]c12.Cl.Oc1cccc2c(C3Nc4ccccc4C34CCCCC4)c[nH]c12.c1ccc2c(c1)NC(c1c[nH]c3ccccc13)C21CCCCC1
InChIInChI=1S/C27H28N2O.C25H28N2.C21H22N2O.C21H22N2.C20H21N.2C19H20N2.C18H18N2.C18H16N2.CH4.ClH/c1-19-9-8-10-20(17-19)30-16-15-29-18-22(21-11-4-7-14-25(21)29)26-27(2,3)23-12-5-6-13-24(23)28-26;1-24(2)17-10-6-5-9-16(17)15-19(24)21-13-14-22(26-21)23-25(3,4)18-11-7-8-12-20(18)27-23;24-18-10-6-7-14-15(13-22-19(14)18)20-21(11-4-1-5-12-21)16-8-2-3-9-17(16)23-20;1-6-12-21(13-7-1)17-9-3-5-11-19(17)23-20(21)16-14-22-18-10-4-2-8-15(16)18;1-13-8-9-15-16(12-21-19(15)10-13)18-11-14-6-4-5-7-17(14)20(18,2)3;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;1-12-8-9-16-13(10-12)14(11-20-16)18-19(2,3)15-6-4-5-7-17(15)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;;/h4-14,17-18,26,28H,15-16H2,1-3H3;5-14,19,23,26-27H,15H2,1-4H3;2-3,6-10,13,20,22-24H,1,4-5,11-12H2;2-5,8-11,14,20,22-23H,1,6-7,12-13H2;4-10,12,18,21H,11H2,1-3H3;2*4-11,18,20-21H,1-3H3;3-11,17,19-20H,1-2H3;3-11,19H,1-2H3;1H4;1H
InChIKeyFWTWFJFIZMZUJF-UHFFFAOYSA-N
XLogP48.51
TPSA257.28 Ų
H-Bond Donors16
H-Bond Acceptors11
Rotatable Bonds14
Heavy Atoms209
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002777.25
LogP ≤ 548.51
H-Bond Donors ≤ 516
H-Bond Acceptors ≤ 1011

Analyze 3-(3,3-dimethyl-1,2-dihydroinden-2-yl)-6-methyl-1H-indole;2-[5-(3,3-dimethyl-1,2-dihydroinden-2-yl)-1H-pyrrol-2-yl]-3,3-dimethyl-1,2-dihydroindole;3-(3,3-dimethyl-1,2-dihydroindol-2-yl)-5-methyl-1H-indole;3-(3,3-dimethyl-1,2-dihydroindol-2-yl)-7-methyl-1H-indole;3-(3,3-dimethyl-1,2-dihydroindol-2-yl)-1-[2-(3-methylphenoxy)ethyl]indole;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];methane;3-spiro[1,2-dihydroindole-3,1'-cyclohexane]-2-yl-1H-indol-7-ol;hydrochloride with MolForge

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Related Compounds

5-(1,1-difluoroethyl)-2-(5,6,7-trifluoro-1H-indol-3-yl)quinoline;2-(5,7-difluoro-6-methyl-1H-indol-3-yl)-8-fluoroquinoline;7-fluoro-2-(5-fluoro-6-methyl-1H-indol-3-yl)quinoline;2-(4-fluoro-7-methyl-1H-indol-3-yl)quinoline;2-(1H-indol-3-yl)-3,3-dimethylindole;3-(1H-indol-3-yl)quinoline;2-(7-methoxy-1H-indol-3-yl)-4-methylquinoline;[2-(4-methyl-3H-inden-1-yl)quinolin-5-yl]methanol;6-methyl-2-(7-methyl-1H-indol-3-yl)quinoline
CID 159566042
3-(3,3-dimethyl-1,2-dihydroindol-2-yl)-6-methyl-1H-indole;3-(3,3-dimethyl-1,2-dihydroindol-2-yl)-7-methyl-1H-indole;5-fluoro-3-(1H-indol-2-yl)-1H-indole;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-(1H-indol-3-yl)-5-(trifluoromethyl)-1H-indole;2-(7-methoxy-1H-indol-3-yl)-4-methylquinoline;3-spiro[1,2-dihydroindole-3,1'-cyclohexane]-2-yl-1H-indol-7-ol
CID 160972000
5-[4-[[3-(3,3-dimethyl-1,2-dihydroindol-2-yl)-1H-indol-7-yl]oxymethyl]phenyl]-3,3-dimethyl-2-(1-methylindol-3-yl)-1,2-dihydroindole
CID 123521716
3-(3,3-dimethyl-1,2-dihydroindol-2-yl)-1-methylindole;3-(3,3-dimethyl-1,2-dihydroindol-2-yl)-7-phenylmethoxy-1H-indole
CID 144941270
6-[4-(9,9-dimethylfluoren-2-yl)naphthalen-1-yl]-2-(1H-indol-5-yl)-2,3-dihydro-1,3-benzoxazole
CID 145202361
10-[3-(9,9-dimethylfluoren-2-yl)phenyl]-2-(1H-indol-3-yl)-2,3-dihydronaphtho[2,1-g][1,3]benzoxazole-1,3-diium
CID 152881118
6-tert-butyl-1-methylindole;2-[5-tert-butyl-2-(2-methylpentan-2-yl)indol-1-yl]ethanol;2-(5-tert-butyl-2-propan-2-ylindol-1-yl)ethanol;2,5-ditert-butyl-7-fluoro-1H-indene;3-(2,5-ditert-butyl-6-fluoroindol-1-yl)propan-1-ol;N-[2-(2,5-ditert-butylindol-1-yl)-1-hydroxyethyl]methanesulfonamide;1-(2,5-ditert-butylindol-1-yl)-3-methoxypropan-2-ol;3-(2,5-ditert-butyl-7-methoxyindol-1-yl)propane-1,2-diol
CID 157225791
2-(4-amino-7-methyl-1H-indol-3-yl)ethanol;3-(4-amino-7-methyl-1H-indol-3-yl)propan-1-ol;2,3-dimethyl-7-(2-pyrrol-1-ylethoxy)-1H-indol-4-amine;7-ethyl-1H-indol-4-amine;7-(2-methoxyethoxy)-2,3-dimethyl-1H-indol-4-amine;7-(2-methoxyethoxy)-1H-indol-4-amine;7-methyl-1H-indol-4-amine
CID 157310709
2-(4-amino-7-methyl-1H-indol-3-yl)ethanol;3-(4-amino-7-methyl-1H-indol-3-yl)propan-1-ol;7-ethyl-1H-indol-4-amine;7-(2-methoxyethoxy)-2,3-dimethyl-1H-indol-4-amine;7-methyl-1H-indol-4-amine
CID 157336830
3,6-Bis(6-cyclohexyloxy-9-phenylcarbazol-3-yl)-9-(4-methoxyphenyl)carbazole;3,6-bis[9-(4-methylphenyl)carbazol-3-yl]-9-(3-pyridin-2-ylphenyl)carbazole;3,6-bis(9-phenylcarbazol-3-yl)-9-(4-phenylphenyl)carbazole;9-(4-tert-butylphenyl)-3,6-bis(9-phenylcarbazol-3-yl)carbazole;9-(9,9-dimethylfluoren-2-yl)-3,6-bis(9-phenylcarbazol-3-yl)carbazole;3-[9-(9,9-dimethylfluoren-4-yl)-6-(6-methoxy-9-phenylcarbazol-3-yl)carbazol-3-yl]-6-methoxy-9-phenylcarbazole
CID 157346480
2-(4-amino-2,3-dimethyl-7-propan-2-ylindol-1-yl)ethanol;2-(4-amino-3-ethyl-2-methyl-7-propan-2-yl-1H-inden-1-yl)ethanol;2-(4-amino-7-methoxy-2,3-dimethylindol-1-yl)ethanol;3-ethyl-1,2-dimethyl-7-propan-2-ylindol-4-amine;7-methoxy-2,3-dimethyl-1H-indol-4-amine;7-methoxy-1,2,3-trimethylindol-4-amine
CID 157349463
1-Tert-butyl-9-methylcarbazole;1,8-ditert-butyl-9-methylcarbazole;1,9-dimethylcarbazole;1-methoxy-9-methylcarbazole;(8-methoxy-9-methylcarbazol-1-yl)methanol;9-methyl-1-phenylcarbazole;9-methyl-1-pyridin-4-ylcarbazole;1,3,6,8,9-pentamethylcarbazole;1,8,9-trimethylcarbazole
CID 157744694

Frequently Asked Questions

What is the IUPAC name of 3-(3,3-dimethyl-1,2-dihydroinden-2-yl)-6-methyl-1H-indole;2-[5-(3,3-dimethyl-1,2-dihydroinden-2-yl)-1H-pyrrol-2-yl]-3,3-dimethyl-1,2-dihydroindole;3-(3,3-dimethyl-1,2-dihydroindol-2-yl)-5-methyl-1H-indole;3-(3,3-dimethyl-1,2-dihydroindol-2-yl)-7-methyl-1H-indole;3-(3,3-dimethyl-1,2-dihydroindol-2-yl)-1-[2-(3-methylphenoxy)ethyl]indole;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];methane;3-spiro[1,2-dihydroindole-3,1'-cyclohexane]-2-yl-1H-indol-7-ol;hydrochloride?
The IUPAC name of 3-(3,3-dimethyl-1,2-dihydroinden-2-yl)-6-methyl-1H-indole;2-[5-(3,3-dimethyl-1,2-dihydroinden-2-yl)-1H-pyrrol-2-yl]-3,3-dimethyl-1,2-dihydroindole;3-(3,3-dimethyl-1,2-dihydroindol-2-yl)-5-methyl-1H-indole;3-(3,3-dimethyl-1,2-dihydroindol-2-yl)-7-methyl-1H-indole;3-(3,3-dimethyl-1,2-dihydroindol-2-yl)-1-[2-(3-methylphenoxy)ethyl]indole;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];methane;3-spiro[1,2-dihydroindole-3,1'-cyclohexane]-2-yl-1H-indol-7-ol;hydrochloride (CID 162191138) is 3-(3,3-dimethyl-1,2-dihydroinden-2-yl)-6-methyl-1H-indole;2-[5-(3,3-dimethyl-1,2-dihydroinden-2-yl)-1H-pyrrol-2-yl]-3,3-dimethyl-1,2-dihydroindole;3-(3,3-dimethyl-1,2-dihydroindol-2-yl)-5-methyl-1H-indole;3-(3,3-dimethyl-1,2-dihydroindol-2-yl)-7-methyl-1H-indole;3-(3,3-dimethyl-1,2-dihydroindol-2-yl)-1-[2-(3-methylphenoxy)ethyl]indole;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];methane;3-spiro[1,2-dihydroindole-3,1'-cyclohexane]-2-yl-1H-indol-7-ol;hydrochloride.
What is the SMILES notation for 3-(3,3-dimethyl-1,2-dihydroinden-2-yl)-6-methyl-1H-indole;2-[5-(3,3-dimethyl-1,2-dihydroinden-2-yl)-1H-pyrrol-2-yl]-3,3-dimethyl-1,2-dihydroindole;3-(3,3-dimethyl-1,2-dihydroindol-2-yl)-5-methyl-1H-indole;3-(3,3-dimethyl-1,2-dihydroindol-2-yl)-7-methyl-1H-indole;3-(3,3-dimethyl-1,2-dihydroindol-2-yl)-1-[2-(3-methylphenoxy)ethyl]indole;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];methane;3-spiro[1,2-dihydroindole-3,1'-cyclohexane]-2-yl-1H-indol-7-ol;hydrochloride?
The canonical SMILES for 3-(3,3-dimethyl-1,2-dihydroinden-2-yl)-6-methyl-1H-indole;2-[5-(3,3-dimethyl-1,2-dihydroinden-2-yl)-1H-pyrrol-2-yl]-3,3-dimethyl-1,2-dihydroindole;3-(3,3-dimethyl-1,2-dihydroindol-2-yl)-5-methyl-1H-indole;3-(3,3-dimethyl-1,2-dihydroindol-2-yl)-7-methyl-1H-indole;3-(3,3-dimethyl-1,2-dihydroindol-2-yl)-1-[2-(3-methylphenoxy)ethyl]indole;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];methane;3-spiro[1,2-dihydroindole-3,1'-cyclohexane]-2-yl-1H-indol-7-ol;hydrochloride is C.CC1(C)C(c2c[nH]c3ccccc23)=Nc2ccccc21.CC1(C)c2ccccc2CC1c1ccc(C2Nc3ccccc3C2(C)C)[nH]1.CC1(C)c2ccccc2NC1c1c[nH]c2ccccc12.Cc1ccc2[nH]cc(C3Nc4ccccc4C3(C)C)c2c1.Cc1ccc2c(C3Cc4ccccc4C3(C)C)c[nH]c2c1.Cc1cccc(OCCn2cc(C3Nc4ccccc4C3(C)C)c3ccccc32)c1.Cc1cccc2c(C3Nc4ccccc4C3(C)C)c[nH]c12.Cl.Oc1cccc2c(C3Nc4ccccc4C34CCCCC4)c[nH]c12.c1ccc2c(c1)NC(c1c[nH]c3ccccc13)C21CCCCC1.
What is the InChIKey of 3-(3,3-dimethyl-1,2-dihydroinden-2-yl)-6-methyl-1H-indole;2-[5-(3,3-dimethyl-1,2-dihydroinden-2-yl)-1H-pyrrol-2-yl]-3,3-dimethyl-1,2-dihydroindole;3-(3,3-dimethyl-1,2-dihydroindol-2-yl)-5-methyl-1H-indole;3-(3,3-dimethyl-1,2-dihydroindol-2-yl)-7-methyl-1H-indole;3-(3,3-dimethyl-1,2-dihydroindol-2-yl)-1-[2-(3-methylphenoxy)ethyl]indole;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];methane;3-spiro[1,2-dihydroindole-3,1'-cyclohexane]-2-yl-1H-indol-7-ol;hydrochloride?
The InChIKey is FWTWFJFIZMZUJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H28N2O.C25H28N2.C21H22N2O.C21H22N2.C20H21N.2C19H20N2.C18H18N2.C18H16N2.CH4.ClH/c1-19-9-8-10-20(17-19)30-16-15-29-18-22(21-11-4-7-14-25(21)29)26-27(2,3)23-12-5-6-13-24(23)28-26;1-24(2)17-10-6-5-9-16(17)15-19(24)21-13-14-22(26-21)23-25(3,4)18-11-7-8-12-20(18)27-23;24-18-10-6-7-14-15(13-22-19(14)18)20-21(11-4-1-5-12-21)16-8-2-3-9-17(16)23-20;1-6-12-21(13-7-1)17-9-3-5-11-19(17)23-20(21)16-14-22-18-10-4-2-8-15(16)18;1-13-8-9-15-16(12-21-19(15)10-13)18-11-14-6-4-5-7-17(14)20(18,2)3;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;1-12-8-9-16-13(10-12)14(11-20-16)18-19(2,3)15-6-4-5-7-17(15)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;;/h4-14,17-18,26,28H,15-16H2,1-3H3;5-14,19,23,26-27H,15H2,1-4H3;2-3,6-10,13,20,22-24H,1,4-5,11-12H2;2-5,8-11,14,20,22-23H,1,6-7,12-13H2;4-10,12,18,21H,11H2,1-3H3;2*4-11,18,20-21H,1-3H3;3-11,17,19-20H,1-2H3;3-11,19H,1-2H3;1H4;1H.
What are the key properties of 3-(3,3-dimethyl-1,2-dihydroinden-2-yl)-6-methyl-1H-indole;2-[5-(3,3-dimethyl-1,2-dihydroinden-2-yl)-1H-pyrrol-2-yl]-3,3-dimethyl-1,2-dihydroindole;3-(3,3-dimethyl-1,2-dihydroindol-2-yl)-5-methyl-1H-indole;3-(3,3-dimethyl-1,2-dihydroindol-2-yl)-7-methyl-1H-indole;3-(3,3-dimethyl-1,2-dihydroindol-2-yl)-1-[2-(3-methylphenoxy)ethyl]indole;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];methane;3-spiro[1,2-dihydroindole-3,1'-cyclohexane]-2-yl-1H-indol-7-ol;hydrochloride?
3-(3,3-dimethyl-1,2-dihydroinden-2-yl)-6-methyl-1H-indole;2-[5-(3,3-dimethyl-1,2-dihydroinden-2-yl)-1H-pyrrol-2-yl]-3,3-dimethyl-1,2-dihydroindole;3-(3,3-dimethyl-1,2-dihydroindol-2-yl)-5-methyl-1H-indole;3-(3,3-dimethyl-1,2-dihydroindol-2-yl)-7-methyl-1H-indole;3-(3,3-dimethyl-1,2-dihydroindol-2-yl)-1-[2-(3-methylphenoxy)ethyl]indole;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];methane;3-spiro[1,2-dihydroindole-3,1'-cyclohexane]-2-yl-1H-indol-7-ol;hydrochloride has a molecular weight of 2777.25 g/mol, XLogP of 48.51, 14 rotatable bonds, 16 hydrogen bond donors, and 11 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3,3-dimethyl-1,2-dihydroinden-2-yl)-6-methyl-1H-indole;2-[5-(3,3-dimethyl-1,2-dihydroinden-2-yl)-1H-pyrrol-2-yl]-3,3-dimethyl-1,2-dihydroindole;3-(3,3-dimethyl-1,2-dihydroindol-2-yl)-5-methyl-1H-indole;3-(3,3-dimethyl-1,2-dihydroindol-2-yl)-7-methyl-1H-indole;3-(3,3-dimethyl-1,2-dihydroindol-2-yl)-1-[2-(3-methylphenoxy)ethyl]indole;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];methane;3-spiro[1,2-dihydroindole-3,1'-cyclohexane]-2-yl-1H-indol-7-ol;hydrochloride is sourced from PubChem (CID 162191138), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).