7,7-dimethyl-12-naphthalen-1-yl-3-(9-naphthalen-1-ylcarbazol-3-yl)indeno[1,2-a]carbazole;12,12-dimethyl-11-naphthalen-1-yl-8-(9-naphthalen-1-ylcarbazol-3-yl)indeno[2,1-a]carbazole

C106H72N4 — CID 157102443

IUPAC7,7-dimethyl-12-naphthalen-1-yl-3-(9-naphthalen-1-ylcarbazol-3-yl)indeno[1,2-a]carbazole;12,12-dimethyl-11-naphthalen-1-yl-8-(9-naphthalen-1-ylcarbazol-3-yl)indeno[2,1-a]carbazole
SMILESCC1(C)c2ccccc2-c2c1ccc1c3cc(-c4ccc5c(c4)c4ccccc4n5-c4cccc5ccccc45)ccc3n(-c3cccc4ccccc34)c21.CC1(C)c2ccccc2-c2ccc3c4cc(-c5ccc6c(c5)c5ccccc5n6-c5cccc6ccccc56)ccc4n(-c4cccc5ccccc45)c3c21
InChIInChI=1S/2C53H36N2/c1-53(2)44-21-9-7-20-41(44)51-45(53)28-27-40-43-32-36(26-30-50(43)55(52(40)51)47-24-12-16-34-14-4-6-18-38(34)47)35-25-29-49-42(31-35)39-19-8-10-22-48(39)54(49)46-23-11-15-33-13-3-5-17-37(33)46;1-53(2)45-21-9-7-19-39(45)41-27-28-42-44-32-36(26-30-50(44)55(52(42)51(41)53)47-24-12-16-34-14-4-6-18-38(34)47)35-25-29-49-43(31-35)40-20-8-10-22-48(40)54(49)46-23-11-15-33-13-3-5-17-37(33)46/h2*3-32H,1-2H3
InChIKeyAFXMJNSSRYVLKM-UHFFFAOYSA-N
MW1401.77 g/mol
LogP28.32
Rot. Bonds6

About 7,7-dimethyl-12-naphthalen-1-yl-3-(9-naphthalen-1-ylcarbazol-3-yl)indeno[1,2-a]carbazole;12,12-dimethyl-11-naphthalen-1-yl-8-(9-naphthalen-1-ylcarbazol-3-yl)indeno[2,1-a]carbazole

7,7-dimethyl-12-naphthalen-1-yl-3-(9-naphthalen-1-ylcarbazol-3-yl)indeno[1,2-a]carbazole;12,12-dimethyl-11-naphthalen-1-yl-8-(9-naphthalen-1-ylcarbazol-3-yl)indeno[2,1-a]carbazole (PubChem CID 157102443) has the molecular formula C106H72N4 and a molecular weight of 1401.77 g/mol. Its IUPAC name is 7,7-dimethyl-12-naphthalen-1-yl-3-(9-naphthalen-1-ylcarbazol-3-yl)indeno[1,2-a]carbazole;12,12-dimethyl-11-naphthalen-1-yl-8-(9-naphthalen-1-ylcarbazol-3-yl)indeno[2,1-a]carbazole.

Molecular Properties

Compound Name7,7-dimethyl-12-naphthalen-1-yl-3-(9-naphthalen-1-ylcarbazol-3-yl)indeno[1,2-a]carbazole;12,12-dimethyl-11-naphthalen-1-yl-8-(9-naphthalen-1-ylcarbazol-3-yl)indeno[2,1-a]carbazole
PubChem CID157102443
Molecular FormulaC106H72N4
Molecular Weight1401.77 g/mol
Exact Mass1400.58
IUPAC Name7,7-dimethyl-12-naphthalen-1-yl-3-(9-naphthalen-1-ylcarbazol-3-yl)indeno[1,2-a]carbazole;12,12-dimethyl-11-naphthalen-1-yl-8-(9-naphthalen-1-ylcarbazol-3-yl)indeno[2,1-a]carbazole
SMILESCC1(C)c2ccccc2-c2c1ccc1c3cc(-c4ccc5c(c4)c4ccccc4n5-c4cccc5ccccc45)ccc3n(-c3cccc4ccccc34)c21.CC1(C)c2ccccc2-c2ccc3c4cc(-c5ccc6c(c5)c5ccccc5n6-c5cccc6ccccc56)ccc4n(-c4cccc5ccccc45)c3c21
InChIInChI=1S/2C53H36N2/c1-53(2)44-21-9-7-20-41(44)51-45(53)28-27-40-43-32-36(26-30-50(43)55(52(40)51)47-24-12-16-34-14-4-6-18-38(34)47)35-25-29-49-42(31-35)39-19-8-10-22-48(39)54(49)46-23-11-15-33-13-3-5-17-37(33)46;1-53(2)45-21-9-7-19-39(45)41-27-28-42-44-32-36(26-30-50(44)55(52(42)51(41)53)47-24-12-16-34-14-4-6-18-38(34)47)35-25-29-49-43(31-35)40-20-8-10-22-48(40)54(49)46-23-11-15-33-13-3-5-17-37(33)46/h2*3-32H,1-2H3
InChIKeyAFXMJNSSRYVLKM-UHFFFAOYSA-N
XLogP28.32
TPSA19.72 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms110
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001401.77
LogP ≤ 528.32
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 7,7-dimethyl-12-naphthalen-1-yl-3-(9-naphthalen-1-ylcarbazol-3-yl)indeno[1,2-a]carbazole;12,12-dimethyl-11-naphthalen-1-yl-8-(9-naphthalen-1-ylcarbazol-3-yl)indeno[2,1-a]carbazole with MolForge

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Related Compounds

7,7-dimethyl-3-(9-naphthalen-1-ylcarbazol-3-yl)-12-phenylindeno[1,2-a]carbazole
CID 145080031
12,12-dimethyl-11-naphthalen-1-yl-8-[9-(3-phenylphenyl)carbazol-3-yl]indeno[2,1-a]carbazole
CID 121344070
3-[7-[9,9-dimethyl-7-(9-naphthalen-1-ylcarbazol-3-yl)fluoren-2-yl]-9,9-dimethylfluoren-2-yl]-9-naphthalen-1-ylcarbazole
CID 59236166
14,14-dimethyl-9-naphthalen-1-yl-9-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;7,7-dimethyl-5-naphthalen-1-ylindeno[2,1-b]carbazole;14,14-dimethyl-9-phenyl-9-azapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaene;7,7-dimethyl-12-phenylindeno[1,2-a]carbazole;7,7-dimethyl-5-phenylindeno[2,1-b]carbazole;12,12-dimethyl-5-phenylindeno[1,2-c]carbazole
CID 161042554
2-(12,12-dimethylindeno[2,1-a]carbazol-11-yl)-5-(10-phenylbenzo[c]carbazol-7-yl)benzene-1,4-dicarbonitrile
CID 121328709
3-[4-[9,9-dimethyl-7-[4-(9-naphthalen-1-ylcarbazol-3-yl)naphthalen-1-yl]fluoren-2-yl]naphthalen-1-yl]-9-naphthalen-1-ylcarbazole
CID 59236729
14,14-dimethyl-9-naphthalen-1-yl-5-[9-(3-phenylphenyl)carbazol-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-1-yl-2-[9-(3-phenylphenyl)carbazol-3-yl]indeno[1,2-b]carbazole;12,12-dimethyl-5-naphthalen-1-yl-2-[9-(3-phenylphenyl)carbazol-3-yl]indeno[1,2-c]carbazole
CID 159771770
12-[4-(9,9-dimethylfluoren-3-yl)phenyl]-7,7-dimethylindeno[1,2-a]carbazole
CID 118502376
8-[9-(9,9-dimethylfluoren-2-yl)carbazol-3-yl]-12,12-dimethyl-11-phenylindeno[2,1-a]carbazole
CID 130289398
14,14-dimethyl-9-naphthalen-1-yl-6-phenyl-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
CID 154948027
9-naphthalen-1-yl-3-[4-[7'-[7'-[4-(9-naphthalen-1-ylcarbazol-3-yl)phenyl]-9,9'-spirobi[fluorene]-2'-yl]-9,9'-spirobi[fluorene]-2'-yl]phenyl]carbazole
CID 59236395
6-(9,9-dimethylfluoren-3-yl)-2-(4,6-diphenyl-1,3,5-triazin-2-yl)-9-naphthalen-1-ylcarbazole
CID 145327658

Frequently Asked Questions

What is the IUPAC name of 7,7-dimethyl-12-naphthalen-1-yl-3-(9-naphthalen-1-ylcarbazol-3-yl)indeno[1,2-a]carbazole;12,12-dimethyl-11-naphthalen-1-yl-8-(9-naphthalen-1-ylcarbazol-3-yl)indeno[2,1-a]carbazole?
The IUPAC name of 7,7-dimethyl-12-naphthalen-1-yl-3-(9-naphthalen-1-ylcarbazol-3-yl)indeno[1,2-a]carbazole;12,12-dimethyl-11-naphthalen-1-yl-8-(9-naphthalen-1-ylcarbazol-3-yl)indeno[2,1-a]carbazole (CID 157102443) is 7,7-dimethyl-12-naphthalen-1-yl-3-(9-naphthalen-1-ylcarbazol-3-yl)indeno[1,2-a]carbazole;12,12-dimethyl-11-naphthalen-1-yl-8-(9-naphthalen-1-ylcarbazol-3-yl)indeno[2,1-a]carbazole.
What is the SMILES notation for 7,7-dimethyl-12-naphthalen-1-yl-3-(9-naphthalen-1-ylcarbazol-3-yl)indeno[1,2-a]carbazole;12,12-dimethyl-11-naphthalen-1-yl-8-(9-naphthalen-1-ylcarbazol-3-yl)indeno[2,1-a]carbazole?
The canonical SMILES for 7,7-dimethyl-12-naphthalen-1-yl-3-(9-naphthalen-1-ylcarbazol-3-yl)indeno[1,2-a]carbazole;12,12-dimethyl-11-naphthalen-1-yl-8-(9-naphthalen-1-ylcarbazol-3-yl)indeno[2,1-a]carbazole is CC1(C)c2ccccc2-c2c1ccc1c3cc(-c4ccc5c(c4)c4ccccc4n5-c4cccc5ccccc45)ccc3n(-c3cccc4ccccc34)c21.CC1(C)c2ccccc2-c2ccc3c4cc(-c5ccc6c(c5)c5ccccc5n6-c5cccc6ccccc56)ccc4n(-c4cccc5ccccc45)c3c21.
What is the InChIKey of 7,7-dimethyl-12-naphthalen-1-yl-3-(9-naphthalen-1-ylcarbazol-3-yl)indeno[1,2-a]carbazole;12,12-dimethyl-11-naphthalen-1-yl-8-(9-naphthalen-1-ylcarbazol-3-yl)indeno[2,1-a]carbazole?
The InChIKey is AFXMJNSSRYVLKM-UHFFFAOYSA-N. The full InChI is InChI=1S/2C53H36N2/c1-53(2)44-21-9-7-20-41(44)51-45(53)28-27-40-43-32-36(26-30-50(43)55(52(40)51)47-24-12-16-34-14-4-6-18-38(34)47)35-25-29-49-42(31-35)39-19-8-10-22-48(39)54(49)46-23-11-15-33-13-3-5-17-37(33)46;1-53(2)45-21-9-7-19-39(45)41-27-28-42-44-32-36(26-30-50(44)55(52(42)51(41)53)47-24-12-16-34-14-4-6-18-38(34)47)35-25-29-49-43(31-35)40-20-8-10-22-48(40)54(49)46-23-11-15-33-13-3-5-17-37(33)46/h2*3-32H,1-2H3.
What are the key properties of 7,7-dimethyl-12-naphthalen-1-yl-3-(9-naphthalen-1-ylcarbazol-3-yl)indeno[1,2-a]carbazole;12,12-dimethyl-11-naphthalen-1-yl-8-(9-naphthalen-1-ylcarbazol-3-yl)indeno[2,1-a]carbazole?
7,7-dimethyl-12-naphthalen-1-yl-3-(9-naphthalen-1-ylcarbazol-3-yl)indeno[1,2-a]carbazole;12,12-dimethyl-11-naphthalen-1-yl-8-(9-naphthalen-1-ylcarbazol-3-yl)indeno[2,1-a]carbazole has a molecular weight of 1401.77 g/mol, XLogP of 28.32, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7,7-dimethyl-12-naphthalen-1-yl-3-(9-naphthalen-1-ylcarbazol-3-yl)indeno[1,2-a]carbazole;12,12-dimethyl-11-naphthalen-1-yl-8-(9-naphthalen-1-ylcarbazol-3-yl)indeno[2,1-a]carbazole is sourced from PubChem (CID 157102443), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).