5,12-dimethyl-9-[(9-methylcarbazol-2-yl)methyl]indolo[3,2-c]carbazole

C34H27N3 — CID 134194420

IUPAC5,12-dimethyl-9-[(9-methylcarbazol-2-yl)methyl]indolo[3,2-c]carbazole
SMILESCn1c2ccccc2c2ccc(Cc3ccc4c(c3)c3ccc5c(c6ccccc6n5C)c3n4C)cc21
InChIInChI=1S/C34H27N3/c1-35-29-11-7-5-9-26(29)33-31(35)17-15-25-27-19-21(13-16-30(27)37(3)34(25)33)18-22-12-14-24-23-8-4-6-10-28(23)36(2)32(24)20-22/h4-17,19-20H,18H2,1-3H3
InChIKeyAORZDJLGHJIAHI-UHFFFAOYSA-N
MW477.61 g/mol
LogP8.21
Rot. Bonds2

About 5,12-dimethyl-9-[(9-methylcarbazol-2-yl)methyl]indolo[3,2-c]carbazole

5,12-dimethyl-9-[(9-methylcarbazol-2-yl)methyl]indolo[3,2-c]carbazole (PubChem CID 134194420) has the molecular formula C34H27N3 and a molecular weight of 477.61 g/mol. Its IUPAC name is 5,12-dimethyl-9-[(9-methylcarbazol-2-yl)methyl]indolo[3,2-c]carbazole.

Molecular Properties

Compound Name5,12-dimethyl-9-[(9-methylcarbazol-2-yl)methyl]indolo[3,2-c]carbazole
PubChem CID134194420
Molecular FormulaC34H27N3
Molecular Weight477.61 g/mol
Exact Mass477.22
IUPAC Name5,12-dimethyl-9-[(9-methylcarbazol-2-yl)methyl]indolo[3,2-c]carbazole
SMILESCn1c2ccccc2c2ccc(Cc3ccc4c(c3)c3ccc5c(c6ccccc6n5C)c3n4C)cc21
InChIInChI=1S/C34H27N3/c1-35-29-11-7-5-9-26(29)33-31(35)17-15-25-27-19-21(13-16-30(27)37(3)34(25)33)18-22-12-14-24-23-8-4-6-10-28(23)36(2)32(24)20-22/h4-17,19-20H,18H2,1-3H3
InChIKeyAORZDJLGHJIAHI-UHFFFAOYSA-N
XLogP8.21
TPSA14.79 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms37
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500477.61
LogP ≤ 58.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

5,12-dimethyl-10-[(9-methylcarbazol-2-yl)methyl]indolo[3,2-c]carbazole
CID 134194410
2-[(4,9-dimethylcarbazol-1-yl)methyl]-5,6,9-trimethylcarbazole
CID 138661064
2-ethyl-9-methylcarbazole
CID 71038255
8,30-dimethyl-5,8,27,30-tetrazatridecacyclo[25.17.1.15,19.02,26.04,24.06,18.07,15.09,14.028,40.029,37.031,36.041,45.023,46]hexatetraconta-1(44),2,4(24),6(18),7(15),9,11,13,16,19(46),20,22,25,28(40),29(37),31,33,35,38,41(45),42-henicosaene;14,36-dimethyl-5,14,27,36-tetrazatridecacyclo[25.17.1.15,19.02,26.04,24.06,18.07,15.08,13.028,40.029,37.030,35.041,45.023,46]hexatetraconta-1(44),2,4(24),6(18),7(15),8,10,12,16,19(46),20,22,25,28(40),29(37),30,32,34,38,41(45),42-henicosaene
CID 165023613
9-ethyl-14-methyl-9,14-diazapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;12-ethyl-11-methylindolo[2,3-a]carbazole;5-ethyl-7-methylindolo[2,3-b]carbazole;11-ethyl-5-methylindolo[3,2-b]carbazole;5-ethyl-12-methylindolo[3,2-c]carbazole;12-ethyl-5-methylindolo[3,2-c]carbazole
CID 157390176
16,38-dimethyl-5,16,27,38-tetrazatridecacyclo[25.17.1.15,19.02,26.04,24.06,18.09,17.010,15.028,40.031,39.032,37.041,45.023,46]hexatetraconta-1(45),2,4(24),6(18),7,9(17),10,12,14,19,21,23(46),25,28(40),29,31(39),32,34,36,41,43-henicosaene
CID 146497438
4-[(9-ethylcarbazol-3-yl)methyl]-1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2(7),3,5,8,10,12(19),13,15,17-nonaene
CID 122537699
N,N-dimethyl-1-(9-methylcarbazol-3-yl)methanamine
CID 23264168
12-methyl-12-azapentacyclo[11.8.0.02,11.04,9.015,20]henicosa-1(21),2,4,6,8,10,13,15,17,19-decaene;12-methyl-12-azapentacyclo[11.8.0.02,11.05,10.014,19]henicosa-1(13),2(11),3,5,7,9,14,16,18,20-decaene;11-methylbenzo[a]carbazole;5-methylbenzo[b]carbazole;9-methylcarbazole
CID 163692832
12-(3,5-diphenylphenyl)-5-methylindolo[3,2-c]carbazole
CID 149056989
12-methyl-5,10-diphenylindolo[3,2-c]carbazole
CID 176615446
7-methyl-10-(11-methylbenzo[a]carbazol-3-yl)benzo[c]carbazole
CID 134240713

Frequently Asked Questions

What is the IUPAC name of 5,12-dimethyl-9-[(9-methylcarbazol-2-yl)methyl]indolo[3,2-c]carbazole?
The IUPAC name of 5,12-dimethyl-9-[(9-methylcarbazol-2-yl)methyl]indolo[3,2-c]carbazole (CID 134194420) is 5,12-dimethyl-9-[(9-methylcarbazol-2-yl)methyl]indolo[3,2-c]carbazole.
What is the SMILES notation for 5,12-dimethyl-9-[(9-methylcarbazol-2-yl)methyl]indolo[3,2-c]carbazole?
The canonical SMILES for 5,12-dimethyl-9-[(9-methylcarbazol-2-yl)methyl]indolo[3,2-c]carbazole is Cn1c2ccccc2c2ccc(Cc3ccc4c(c3)c3ccc5c(c6ccccc6n5C)c3n4C)cc21.
What is the InChIKey of 5,12-dimethyl-9-[(9-methylcarbazol-2-yl)methyl]indolo[3,2-c]carbazole?
The InChIKey is AORZDJLGHJIAHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C34H27N3/c1-35-29-11-7-5-9-26(29)33-31(35)17-15-25-27-19-21(13-16-30(27)37(3)34(25)33)18-22-12-14-24-23-8-4-6-10-28(23)36(2)32(24)20-22/h4-17,19-20H,18H2,1-3H3.
What are the key properties of 5,12-dimethyl-9-[(9-methylcarbazol-2-yl)methyl]indolo[3,2-c]carbazole?
5,12-dimethyl-9-[(9-methylcarbazol-2-yl)methyl]indolo[3,2-c]carbazole has a molecular weight of 477.61 g/mol, XLogP of 8.21, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5,12-dimethyl-9-[(9-methylcarbazol-2-yl)methyl]indolo[3,2-c]carbazole is sourced from PubChem (CID 134194420), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).