12-[2,6-di(pyren-2-yl)-4-pyridinyl]-5-naphthalen-1-ylindolo[3,2-c]carbazole;12-[2,6-di(pyren-2-yl)-4-pyridinyl]-5-naphthalen-2-ylindolo[3,2-c]carbazole

C130H74N6 — CID 160857395

IUPAC12-[2,6-di(pyren-2-yl)-4-pyridinyl]-5-naphthalen-1-ylindolo[3,2-c]carbazole;12-[2,6-di(pyren-2-yl)-4-pyridinyl]-5-naphthalen-2-ylindolo[3,2-c]carbazole
SMILESc1ccc2c(-n3c4ccccc4c4c3ccc3c5ccccc5n(-c5cc(-c6cc7ccc8cccc9ccc(c6)c7c89)nc(-c6cc7ccc8cccc9ccc(c6)c7c89)c5)c34)cccc2c1.c1ccc2cc(-n3c4ccccc4c4c3ccc3c5ccccc5n(-c5cc(-c6cc7ccc8cccc9ccc(c6)c7c89)nc(-c6cc7ccc8cccc9ccc(c6)c7c89)c5)c34)ccc2c1
InChIInChI=1S/2C65H37N3/c1-2-16-50-38(10-1)11-9-21-56(50)68-58-20-6-4-18-53(58)64-59(68)31-30-52-51-17-3-5-19-57(51)67(65(52)64)49-36-54(47-32-43-26-22-39-12-7-13-40-23-27-44(33-47)62(43)60(39)40)66-55(37-49)48-34-45-28-24-41-14-8-15-42-25-29-46(35-48)63(45)61(41)42;1-2-10-43-35-50(28-27-38(43)9-1)67-58-18-6-4-16-54(58)64-59(67)30-29-53-52-15-3-5-17-57(52)68(65(53)64)51-36-55(48-31-44-23-19-39-11-7-12-40-20-24-45(32-48)62(44)60(39)40)66-56(37-51)49-33-46-25-21-41-13-8-14-42-22-26-47(34-49)63(46)61(41)42/h2*1-37H
InChIKeySKAPVNKWRYVORD-UHFFFAOYSA-N
MW1720.06 g/mol
LogP35.12
Rot. Bonds8

About 12-[2,6-di(pyren-2-yl)-4-pyridinyl]-5-naphthalen-1-ylindolo[3,2-c]carbazole;12-[2,6-di(pyren-2-yl)-4-pyridinyl]-5-naphthalen-2-ylindolo[3,2-c]carbazole

12-[2,6-di(pyren-2-yl)-4-pyridinyl]-5-naphthalen-1-ylindolo[3,2-c]carbazole;12-[2,6-di(pyren-2-yl)-4-pyridinyl]-5-naphthalen-2-ylindolo[3,2-c]carbazole (PubChem CID 160857395) has the molecular formula C130H74N6 and a molecular weight of 1720.06 g/mol. Its IUPAC name is 12-[2,6-di(pyren-2-yl)-4-pyridinyl]-5-naphthalen-1-ylindolo[3,2-c]carbazole;12-[2,6-di(pyren-2-yl)-4-pyridinyl]-5-naphthalen-2-ylindolo[3,2-c]carbazole.

Molecular Properties

Compound Name12-[2,6-di(pyren-2-yl)-4-pyridinyl]-5-naphthalen-1-ylindolo[3,2-c]carbazole;12-[2,6-di(pyren-2-yl)-4-pyridinyl]-5-naphthalen-2-ylindolo[3,2-c]carbazole
PubChem CID160857395
Molecular FormulaC130H74N6
Molecular Weight1720.06 g/mol
Exact Mass1718.60
IUPAC Name12-[2,6-di(pyren-2-yl)-4-pyridinyl]-5-naphthalen-1-ylindolo[3,2-c]carbazole;12-[2,6-di(pyren-2-yl)-4-pyridinyl]-5-naphthalen-2-ylindolo[3,2-c]carbazole
SMILESc1ccc2c(-n3c4ccccc4c4c3ccc3c5ccccc5n(-c5cc(-c6cc7ccc8cccc9ccc(c6)c7c89)nc(-c6cc7ccc8cccc9ccc(c6)c7c89)c5)c34)cccc2c1.c1ccc2cc(-n3c4ccccc4c4c3ccc3c5ccccc5n(-c5cc(-c6cc7ccc8cccc9ccc(c6)c7c89)nc(-c6cc7ccc8cccc9ccc(c6)c7c89)c5)c34)ccc2c1
InChIInChI=1S/2C65H37N3/c1-2-16-50-38(10-1)11-9-21-56(50)68-58-20-6-4-18-53(58)64-59(68)31-30-52-51-17-3-5-19-57(51)67(65(52)64)49-36-54(47-32-43-26-22-39-12-7-13-40-23-27-44(33-47)62(43)60(39)40)66-55(37-49)48-34-45-28-24-41-14-8-15-42-25-29-46(35-48)63(45)61(41)42;1-2-10-43-35-50(28-27-38(43)9-1)67-58-18-6-4-16-54(58)64-59(67)30-29-53-52-15-3-5-17-57(52)68(65(53)64)51-36-55(48-31-44-23-19-39-11-7-12-40-20-24-45(32-48)62(44)60(39)40)66-56(37-51)49-33-46-25-21-41-13-8-14-42-22-26-47(34-49)63(46)61(41)42/h2*1-37H
InChIKeySKAPVNKWRYVORD-UHFFFAOYSA-N
XLogP35.12
TPSA45.50 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms136
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001720.06
LogP ≤ 535.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

Analyze 12-[2,6-di(pyren-2-yl)-4-pyridinyl]-5-naphthalen-1-ylindolo[3,2-c]carbazole;12-[2,6-di(pyren-2-yl)-4-pyridinyl]-5-naphthalen-2-ylindolo[3,2-c]carbazole with MolForge

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Related Compounds

5,12-bis[2,6-di(pyren-2-yl)-4-pyridinyl]indolo[3,2-c]carbazole
CID 58029153
5-(4,6-dinaphthalen-2-yl-1,3,5-triazin-2-yl)-12-phenylindolo[3,2-c]carbazole;5-(4,6-diphenyl-1,3,5-triazin-2-yl)-12-naphthalen-1-ylindolo[3,2-c]carbazole;12-(4,6-diphenyl-1,3,5-triazin-2-yl)-5-naphthalen-1-ylindolo[3,2-c]carbazole;12-[4,6-di(pyren-2-yl)pyrimidin-2-yl]-5-naphthalen-1-ylindolo[3,2-c]carbazole;12-[4,6-di(pyren-2-yl)pyrimidin-2-yl]-5-naphthalen-2-ylindolo[3,2-c]carbazole;12-[4,6-di(pyren-2-yl)pyrimidin-2-yl]-5-(4-phenyl-6-pyren-2-ylpyrimidin-2-yl)indolo[3,2-c]carbazole
CID 158993970
5-[3,5-di(carbazol-9-yl)phenyl]-12-(2,6-dinaphthalen-2-yl-4-pyridinyl)indolo[3,2-c]carbazole
CID 58029134
5-[6-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]-12-naphthalen-2-ylindolo[3,2-c]carbazole
CID 156531291
5,12-bis(6-phenylnaphthalen-2-yl)indolo[3,2-c]carbazole;methane;12-naphthalen-2-yl-5-[4-(4-naphthalen-2-ylphenyl)phenyl]indolo[3,2-c]carbazole;12-naphthalen-1-yl-5-(6-phenylnaphthalen-1-yl)indolo[3,2-c]carbazole;12-naphthalen-2-yl-5-[4-(6-phenylnaphthalen-2-yl)phenyl]indolo[3,2-c]carbazole;12-naphthalen-2-yl-5-[6-(4-phenylphenyl)naphthalen-1-yl]indolo[3,2-c]carbazole;12-naphthalen-2-yl-5-[3-(3-phenylphenyl)phenyl]indolo[3,2-c]carbazole;12-naphthalen-2-yl-5-[4-(3-phenylphenyl)phenyl]indolo[3,2-c]carbazole;12-phenyl-5-[4-(6-phenylnaphthalen-2-yl)phenyl]indolo[3,2-c]carbazole
CID 157244640
9,14-dinaphthalen-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;9-naphthalen-1-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;12-naphthalen-2-yl-11-(4-naphthalen-2-ylphenyl)indolo[2,3-a]carbazole;12-(6-naphthalen-2-ylnaphthalen-2-yl)-11-phenylindolo[2,3-a]carbazole;12-naphthalen-2-yl-11-[4-(4-naphthalen-2-ylphenyl)phenyl]indolo[2,3-a]carbazole;9-naphthalen-2-yl-14-phenyl-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-(3-naphthalen-2-ylphenyl)-11-[4-(4-phenylphenyl)phenyl]indolo[2,3-a]carbazole;12-(4-naphthalen-2-ylphenyl)-11-[4-(4-phenylphenyl)phenyl]indolo[2,3-a]carbazole;12-[4-(6-phenylnaphthalen-2-yl)phenyl]-11-(4-phenylphenyl)indolo[2,3-a]carbazole;12-(6-phenylnaphthalen-2-yl)-11-[4-(4-phenylphenyl)phenyl]indolo[2,3-a]carbazole
CID 157341055
5-[3-(4,6-diphenyl-1,3,5-triazin-2-yl)naphthalen-1-yl]-12-naphthalen-2-ylindolo[3,2-c]carbazole
CID 156530747
12-[2-(2,6-diphenyl-4-pyridinyl)phenyl]-5-naphthalen-2-ylindolo[3,2-c]carbazole
CID 155240850
5-(9-naphthalen-2-ylcarbazol-4-yl)-12-phenylindolo[3,2-c]carbazole;12-(9-naphthalen-2-ylcarbazol-2-yl)-5-phenylindolo[3,2-c]carbazole;12-(9-naphthalen-2-ylcarbazol-4-yl)-5-phenylindolo[3,2-c]carbazole
CID 165021173
9,25-dinaphthalen-1-yl-9,25-diazaoctacyclo[15.15.0.02,10.03,8.011,16.018,26.019,24.027,32]dotriaconta-1(17),2(10),3,5,7,11,13,15,18(26),19,21,23,27,29,31-pentadecaene;9,25-dinaphthalen-2-yl-9,25-diazaoctacyclo[15.15.0.02,10.03,8.011,16.018,26.019,24.027,32]dotriaconta-1(17),2(10),3,5,7,11,13,15,18(26),19,21,23,27,29,31-pentadecaene
CID 160857402
12-[6-(2-naphthalen-2-yl-6-phenyl-4-pyridinyl)naphthalen-2-yl]-5-phenylindolo[3,2-c]carbazole
CID 155240145
5-naphthalen-1-yl-12-[4-(9-phenylcarbazol-3-yl)phenyl]indolo[3,2-c]carbazole
CID 134168763

Frequently Asked Questions

What is the IUPAC name of 12-[2,6-di(pyren-2-yl)-4-pyridinyl]-5-naphthalen-1-ylindolo[3,2-c]carbazole;12-[2,6-di(pyren-2-yl)-4-pyridinyl]-5-naphthalen-2-ylindolo[3,2-c]carbazole?
The IUPAC name of 12-[2,6-di(pyren-2-yl)-4-pyridinyl]-5-naphthalen-1-ylindolo[3,2-c]carbazole;12-[2,6-di(pyren-2-yl)-4-pyridinyl]-5-naphthalen-2-ylindolo[3,2-c]carbazole (CID 160857395) is 12-[2,6-di(pyren-2-yl)-4-pyridinyl]-5-naphthalen-1-ylindolo[3,2-c]carbazole;12-[2,6-di(pyren-2-yl)-4-pyridinyl]-5-naphthalen-2-ylindolo[3,2-c]carbazole.
What is the SMILES notation for 12-[2,6-di(pyren-2-yl)-4-pyridinyl]-5-naphthalen-1-ylindolo[3,2-c]carbazole;12-[2,6-di(pyren-2-yl)-4-pyridinyl]-5-naphthalen-2-ylindolo[3,2-c]carbazole?
The canonical SMILES for 12-[2,6-di(pyren-2-yl)-4-pyridinyl]-5-naphthalen-1-ylindolo[3,2-c]carbazole;12-[2,6-di(pyren-2-yl)-4-pyridinyl]-5-naphthalen-2-ylindolo[3,2-c]carbazole is c1ccc2c(-n3c4ccccc4c4c3ccc3c5ccccc5n(-c5cc(-c6cc7ccc8cccc9ccc(c6)c7c89)nc(-c6cc7ccc8cccc9ccc(c6)c7c89)c5)c34)cccc2c1.c1ccc2cc(-n3c4ccccc4c4c3ccc3c5ccccc5n(-c5cc(-c6cc7ccc8cccc9ccc(c6)c7c89)nc(-c6cc7ccc8cccc9ccc(c6)c7c89)c5)c34)ccc2c1.
What is the InChIKey of 12-[2,6-di(pyren-2-yl)-4-pyridinyl]-5-naphthalen-1-ylindolo[3,2-c]carbazole;12-[2,6-di(pyren-2-yl)-4-pyridinyl]-5-naphthalen-2-ylindolo[3,2-c]carbazole?
The InChIKey is SKAPVNKWRYVORD-UHFFFAOYSA-N. The full InChI is InChI=1S/2C65H37N3/c1-2-16-50-38(10-1)11-9-21-56(50)68-58-20-6-4-18-53(58)64-59(68)31-30-52-51-17-3-5-19-57(51)67(65(52)64)49-36-54(47-32-43-26-22-39-12-7-13-40-23-27-44(33-47)62(43)60(39)40)66-55(37-49)48-34-45-28-24-41-14-8-15-42-25-29-46(35-48)63(45)61(41)42;1-2-10-43-35-50(28-27-38(43)9-1)67-58-18-6-4-16-54(58)64-59(67)30-29-53-52-15-3-5-17-57(52)68(65(53)64)51-36-55(48-31-44-23-19-39-11-7-12-40-20-24-45(32-48)62(44)60(39)40)66-56(37-51)49-33-46-25-21-41-13-8-14-42-22-26-47(34-49)63(46)61(41)42/h2*1-37H.
What are the key properties of 12-[2,6-di(pyren-2-yl)-4-pyridinyl]-5-naphthalen-1-ylindolo[3,2-c]carbazole;12-[2,6-di(pyren-2-yl)-4-pyridinyl]-5-naphthalen-2-ylindolo[3,2-c]carbazole?
12-[2,6-di(pyren-2-yl)-4-pyridinyl]-5-naphthalen-1-ylindolo[3,2-c]carbazole;12-[2,6-di(pyren-2-yl)-4-pyridinyl]-5-naphthalen-2-ylindolo[3,2-c]carbazole has a molecular weight of 1720.06 g/mol, XLogP of 35.12, 8 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 12-[2,6-di(pyren-2-yl)-4-pyridinyl]-5-naphthalen-1-ylindolo[3,2-c]carbazole;12-[2,6-di(pyren-2-yl)-4-pyridinyl]-5-naphthalen-2-ylindolo[3,2-c]carbazole is sourced from PubChem (CID 160857395), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).