11,11-dimethyl-5-(9-naphthalen-2-ylcarbazol-4-yl)indeno[1,2-b]carbazole

C43H30N2 — CID 118502163

IUPAC11,11-dimethyl-5-(9-naphthalen-2-ylcarbazol-4-yl)indeno[1,2-b]carbazole
SMILESCC1(C)c2ccccc2-c2cc3c(cc21)c1ccccc1n3-c1cccc2c1c1ccccc1n2-c1ccc2ccccc2c1
InChIInChI=1S/C43H30N2/c1-43(2)35-17-8-5-14-30(35)33-26-41-34(25-36(33)43)31-15-6-9-18-37(31)45(41)40-21-11-20-39-42(40)32-16-7-10-19-38(32)44(39)29-23-22-27-12-3-4-13-28(27)24-29/h3-26H,1-2H3
InChIKeyBABVIBUBZXLYDQ-UHFFFAOYSA-N
MW574.73 g/mol
LogP11.34
Rot. Bonds2

About 11,11-dimethyl-5-(9-naphthalen-2-ylcarbazol-4-yl)indeno[1,2-b]carbazole

11,11-dimethyl-5-(9-naphthalen-2-ylcarbazol-4-yl)indeno[1,2-b]carbazole (PubChem CID 118502163) has the molecular formula C43H30N2 and a molecular weight of 574.73 g/mol. Its IUPAC name is 11,11-dimethyl-5-(9-naphthalen-2-ylcarbazol-4-yl)indeno[1,2-b]carbazole.

Molecular Properties

Compound Name11,11-dimethyl-5-(9-naphthalen-2-ylcarbazol-4-yl)indeno[1,2-b]carbazole
PubChem CID118502163
Molecular FormulaC43H30N2
Molecular Weight574.73 g/mol
Exact Mass574.24
IUPAC Name11,11-dimethyl-5-(9-naphthalen-2-ylcarbazol-4-yl)indeno[1,2-b]carbazole
SMILESCC1(C)c2ccccc2-c2cc3c(cc21)c1ccccc1n3-c1cccc2c1c1ccccc1n2-c1ccc2ccccc2c1
InChIInChI=1S/C43H30N2/c1-43(2)35-17-8-5-14-30(35)33-26-41-34(25-36(33)43)31-15-6-9-18-37(31)45(41)40-21-11-20-39-42(40)32-16-7-10-19-38(32)44(39)29-23-22-27-12-3-4-13-28(27)24-29/h3-26H,1-2H3
InChIKeyBABVIBUBZXLYDQ-UHFFFAOYSA-N
XLogP11.34
TPSA9.86 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms45
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500574.73
LogP ≤ 511.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

11,11-dimethyl-5-(9-naphthalen-2-ylcarbazol-4-yl)indeno[1,2-b]carbazole;11,11-dimethyl-5-(9-phenylcarbazol-1-yl)indeno[1,2-b]carbazole;11,11-dimethyl-5-(9-phenylcarbazol-3-yl)indeno[1,2-b]carbazole;11,11-dimethyl-5-(4-phenylphenyl)indeno[1,2-b]carbazole;methane
CID 162243824
9-(9,9-dimethylfluoren-3-yl)-14-[9-(4,6-dinaphthalen-1-yl-1,3,5-triazin-2-yl)carbazol-4-yl]-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;9-[9-(4,6-dinaphthalen-1-yl-1,3,5-triazin-2-yl)carbazol-4-yl]-14-naphthalen-1-yl-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;9-[9-(4,6-dinaphthalen-1-yl-1,3,5-triazin-2-yl)carbazol-4-yl]-14-naphthalen-2-yl-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
CID 157067206
2-benzo[c]carbazol-7-yl-5-(2-carbazol-9-yl-11,11-dimethylindeno[1,2-b]carbazol-5-yl)benzene-1,4-dicarbonitrile
CID 121328849
3-(4-carbazol-9-ylcarbazol-9-yl)-9-(3-carbazol-9-ylphenyl)carbazole;4-carbazol-9-yl-9-(6-carbazol-9-yl-9,9-dimethylfluoren-3-yl)carbazole;4-carbazol-9-yl-9-(6-carbazol-9-ylphenanthren-3-yl)carbazole
CID 158770389
12,12-dimethyl-16-naphthalen-2-yl-16-azahexacyclo[11.11.0.02,11.04,9.015,23.017,22]tetracosa-1(13),2,4,6,8,10,14,17,19,21,23-undecaene
CID 122464085
14,14-dimethyl-9-naphthalen-2-yl-5-(9-phenylcarbazol-3-yl)-9-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3(8),4,6,11,15,17,19-nonaene;11,11-dimethyl-5-naphthalen-2-yl-2-(9-phenylcarbazol-3-yl)indeno[1,2-b]carbazole
CID 159742124
6-(11,11-dimethylindeno[1,2-b]carbazol-5-yl)-N-(4-naphthalen-2-ylphenyl)-N-phenylnaphthalen-2-amine
CID 139500760
2-[2-(9,9-dimethylfluoren-2-yl)phenyl]-9-naphthalen-2-ylcarbazole
CID 129312240
11,11-dimethyl-5-triphenylen-2-ylindeno[1,2-b]carbazole
CID 118488496
7,7-dimethyl-5-(8-methylnaphthalen-1-yl)indeno[2,1-b]carbazole
CID 155130310
5-[6-(12,12-dimethylindeno[1,2-c]carbazol-5-yl)naphthalen-2-yl]-12,12-dimethylindeno[1,2-c]carbazole
CID 122548689
CID 134551753
CID 134551753

Frequently Asked Questions

What is the IUPAC name of 11,11-dimethyl-5-(9-naphthalen-2-ylcarbazol-4-yl)indeno[1,2-b]carbazole?
The IUPAC name of 11,11-dimethyl-5-(9-naphthalen-2-ylcarbazol-4-yl)indeno[1,2-b]carbazole (CID 118502163) is 11,11-dimethyl-5-(9-naphthalen-2-ylcarbazol-4-yl)indeno[1,2-b]carbazole.
What is the SMILES notation for 11,11-dimethyl-5-(9-naphthalen-2-ylcarbazol-4-yl)indeno[1,2-b]carbazole?
The canonical SMILES for 11,11-dimethyl-5-(9-naphthalen-2-ylcarbazol-4-yl)indeno[1,2-b]carbazole is CC1(C)c2ccccc2-c2cc3c(cc21)c1ccccc1n3-c1cccc2c1c1ccccc1n2-c1ccc2ccccc2c1.
What is the InChIKey of 11,11-dimethyl-5-(9-naphthalen-2-ylcarbazol-4-yl)indeno[1,2-b]carbazole?
The InChIKey is BABVIBUBZXLYDQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C43H30N2/c1-43(2)35-17-8-5-14-30(35)33-26-41-34(25-36(33)43)31-15-6-9-18-37(31)45(41)40-21-11-20-39-42(40)32-16-7-10-19-38(32)44(39)29-23-22-27-12-3-4-13-28(27)24-29/h3-26H,1-2H3.
What are the key properties of 11,11-dimethyl-5-(9-naphthalen-2-ylcarbazol-4-yl)indeno[1,2-b]carbazole?
11,11-dimethyl-5-(9-naphthalen-2-ylcarbazol-4-yl)indeno[1,2-b]carbazole has a molecular weight of 574.73 g/mol, XLogP of 11.34, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 11,11-dimethyl-5-(9-naphthalen-2-ylcarbazol-4-yl)indeno[1,2-b]carbazole is sourced from PubChem (CID 118502163), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).