6-[3-(9,9-diphenylfluoren-2-yl)phenyl]-3-phenylpyrrolo[2,3-c]carbazole;3-phenyl-6-[4-(9,9'-spirobi[fluorene]-2-yl)phenyl]pyrrolo[2,3-c]carbazole;3-phenyl-6-(9,9'-spirobi[fluorene]-2-yl)pyrrolo[2,3-c]carbazole

C147H94N6 — CID 161056569

IUPAC6-[3-(9,9-diphenylfluoren-2-yl)phenyl]-3-phenylpyrrolo[2,3-c]carbazole;3-phenyl-6-[4-(9,9'-spirobi[fluorene]-2-yl)phenyl]pyrrolo[2,3-c]carbazole;3-phenyl-6-(9,9'-spirobi[fluorene]-2-yl)pyrrolo[2,3-c]carbazole
SMILESc1ccc(-n2ccc3c4c5ccccc5n(-c5ccc(-c6ccc7c(c6)C6(c8ccccc8-c8ccccc86)c6ccccc6-7)cc5)c4ccc32)cc1.c1ccc(-n2ccc3c4c5ccccc5n(-c5ccc6c(c5)C5(c7ccccc7-c7ccccc75)c5ccccc5-6)c4ccc32)cc1.c1ccc(-n2ccc3c4c5ccccc5n(-c5cccc(-c6ccc7c(c6)C(c6ccccc6)(c6ccccc6)c6ccccc6-7)c5)c4ccc32)cc1
InChIInChI=1S/C51H32N2.C51H34N2.C45H28N2/c1-2-12-35(13-3-1)52-31-30-42-47(52)28-29-49-50(42)41-17-7-11-21-48(41)53(49)36-25-22-33(23-26-36)34-24-27-40-39-16-6-10-20-45(39)51(46(40)32-34)43-18-8-4-14-37(43)38-15-5-9-19-44(38)51;1-4-16-37(17-5-1)51(38-18-6-2-7-19-38)45-25-12-10-23-41(45)42-28-27-36(34-46(42)51)35-15-14-22-40(33-35)53-48-26-13-11-24-43(48)50-44-31-32-52(39-20-8-3-9-21-39)47(44)29-30-49(50)53;1-2-12-29(13-3-1)46-27-26-36-41(46)24-25-43-44(36)35-17-7-11-21-42(35)47(43)30-22-23-34-33-16-6-10-20-39(33)45(40(34)28-30)37-18-8-4-14-31(37)32-15-5-9-19-38(32)45/h1-32H;1-34H;1-28H
InChIKeyUCVIQMYUAODZLW-UHFFFAOYSA-N
MW1944.41 g/mol
LogP36.57
Rot. Bonds10

About 6-[3-(9,9-diphenylfluoren-2-yl)phenyl]-3-phenylpyrrolo[2,3-c]carbazole;3-phenyl-6-[4-(9,9'-spirobi[fluorene]-2-yl)phenyl]pyrrolo[2,3-c]carbazole;3-phenyl-6-(9,9'-spirobi[fluorene]-2-yl)pyrrolo[2,3-c]carbazole

6-[3-(9,9-diphenylfluoren-2-yl)phenyl]-3-phenylpyrrolo[2,3-c]carbazole;3-phenyl-6-[4-(9,9'-spirobi[fluorene]-2-yl)phenyl]pyrrolo[2,3-c]carbazole;3-phenyl-6-(9,9'-spirobi[fluorene]-2-yl)pyrrolo[2,3-c]carbazole (PubChem CID 161056569) has the molecular formula C147H94N6 and a molecular weight of 1944.41 g/mol. Its IUPAC name is 6-[3-(9,9-diphenylfluoren-2-yl)phenyl]-3-phenylpyrrolo[2,3-c]carbazole;3-phenyl-6-[4-(9,9'-spirobi[fluorene]-2-yl)phenyl]pyrrolo[2,3-c]carbazole;3-phenyl-6-(9,9'-spirobi[fluorene]-2-yl)pyrrolo[2,3-c]carbazole.

Molecular Properties

Compound Name6-[3-(9,9-diphenylfluoren-2-yl)phenyl]-3-phenylpyrrolo[2,3-c]carbazole;3-phenyl-6-[4-(9,9'-spirobi[fluorene]-2-yl)phenyl]pyrrolo[2,3-c]carbazole;3-phenyl-6-(9,9'-spirobi[fluorene]-2-yl)pyrrolo[2,3-c]carbazole
PubChem CID161056569
Molecular FormulaC147H94N6
Molecular Weight1944.41 g/mol
Exact Mass1942.75
IUPAC Name6-[3-(9,9-diphenylfluoren-2-yl)phenyl]-3-phenylpyrrolo[2,3-c]carbazole;3-phenyl-6-[4-(9,9'-spirobi[fluorene]-2-yl)phenyl]pyrrolo[2,3-c]carbazole;3-phenyl-6-(9,9'-spirobi[fluorene]-2-yl)pyrrolo[2,3-c]carbazole
SMILESc1ccc(-n2ccc3c4c5ccccc5n(-c5ccc(-c6ccc7c(c6)C6(c8ccccc8-c8ccccc86)c6ccccc6-7)cc5)c4ccc32)cc1.c1ccc(-n2ccc3c4c5ccccc5n(-c5ccc6c(c5)C5(c7ccccc7-c7ccccc75)c5ccccc5-6)c4ccc32)cc1.c1ccc(-n2ccc3c4c5ccccc5n(-c5cccc(-c6ccc7c(c6)C(c6ccccc6)(c6ccccc6)c6ccccc6-7)c5)c4ccc32)cc1
InChIInChI=1S/C51H32N2.C51H34N2.C45H28N2/c1-2-12-35(13-3-1)52-31-30-42-47(52)28-29-49-50(42)41-17-7-11-21-48(41)53(49)36-25-22-33(23-26-36)34-24-27-40-39-16-6-10-20-45(39)51(46(40)32-34)43-18-8-4-14-37(43)38-15-5-9-19-44(38)51;1-4-16-37(17-5-1)51(38-18-6-2-7-19-38)45-25-12-10-23-41(45)42-28-27-36(34-46(42)51)35-15-14-22-40(33-35)53-48-26-13-11-24-43(48)50-44-31-32-52(39-20-8-3-9-21-39)47(44)29-30-49(50)53;1-2-12-29(13-3-1)46-27-26-36-41(46)24-25-43-44(36)35-17-7-11-21-42(35)47(43)30-22-23-34-33-16-6-10-20-39(33)45(40(34)28-30)37-18-8-4-14-31(37)32-15-5-9-19-38(32)45/h1-32H;1-34H;1-28H
InChIKeyUCVIQMYUAODZLW-UHFFFAOYSA-N
XLogP36.57
TPSA29.58 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds10
Heavy Atoms153
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001944.41
LogP ≤ 536.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 6-[3-(9,9-diphenylfluoren-2-yl)phenyl]-3-phenylpyrrolo[2,3-c]carbazole;3-phenyl-6-[4-(9,9'-spirobi[fluorene]-2-yl)phenyl]pyrrolo[2,3-c]carbazole;3-phenyl-6-(9,9'-spirobi[fluorene]-2-yl)pyrrolo[2,3-c]carbazole with MolForge

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Frequently Asked Questions

What is the IUPAC name of 6-[3-(9,9-diphenylfluoren-2-yl)phenyl]-3-phenylpyrrolo[2,3-c]carbazole;3-phenyl-6-[4-(9,9'-spirobi[fluorene]-2-yl)phenyl]pyrrolo[2,3-c]carbazole;3-phenyl-6-(9,9'-spirobi[fluorene]-2-yl)pyrrolo[2,3-c]carbazole?
The IUPAC name of 6-[3-(9,9-diphenylfluoren-2-yl)phenyl]-3-phenylpyrrolo[2,3-c]carbazole;3-phenyl-6-[4-(9,9'-spirobi[fluorene]-2-yl)phenyl]pyrrolo[2,3-c]carbazole;3-phenyl-6-(9,9'-spirobi[fluorene]-2-yl)pyrrolo[2,3-c]carbazole (CID 161056569) is 6-[3-(9,9-diphenylfluoren-2-yl)phenyl]-3-phenylpyrrolo[2,3-c]carbazole;3-phenyl-6-[4-(9,9'-spirobi[fluorene]-2-yl)phenyl]pyrrolo[2,3-c]carbazole;3-phenyl-6-(9,9'-spirobi[fluorene]-2-yl)pyrrolo[2,3-c]carbazole.
What is the SMILES notation for 6-[3-(9,9-diphenylfluoren-2-yl)phenyl]-3-phenylpyrrolo[2,3-c]carbazole;3-phenyl-6-[4-(9,9'-spirobi[fluorene]-2-yl)phenyl]pyrrolo[2,3-c]carbazole;3-phenyl-6-(9,9'-spirobi[fluorene]-2-yl)pyrrolo[2,3-c]carbazole?
The canonical SMILES for 6-[3-(9,9-diphenylfluoren-2-yl)phenyl]-3-phenylpyrrolo[2,3-c]carbazole;3-phenyl-6-[4-(9,9'-spirobi[fluorene]-2-yl)phenyl]pyrrolo[2,3-c]carbazole;3-phenyl-6-(9,9'-spirobi[fluorene]-2-yl)pyrrolo[2,3-c]carbazole is c1ccc(-n2ccc3c4c5ccccc5n(-c5ccc(-c6ccc7c(c6)C6(c8ccccc8-c8ccccc86)c6ccccc6-7)cc5)c4ccc32)cc1.c1ccc(-n2ccc3c4c5ccccc5n(-c5ccc6c(c5)C5(c7ccccc7-c7ccccc75)c5ccccc5-6)c4ccc32)cc1.c1ccc(-n2ccc3c4c5ccccc5n(-c5cccc(-c6ccc7c(c6)C(c6ccccc6)(c6ccccc6)c6ccccc6-7)c5)c4ccc32)cc1.
What is the InChIKey of 6-[3-(9,9-diphenylfluoren-2-yl)phenyl]-3-phenylpyrrolo[2,3-c]carbazole;3-phenyl-6-[4-(9,9'-spirobi[fluorene]-2-yl)phenyl]pyrrolo[2,3-c]carbazole;3-phenyl-6-(9,9'-spirobi[fluorene]-2-yl)pyrrolo[2,3-c]carbazole?
The InChIKey is UCVIQMYUAODZLW-UHFFFAOYSA-N. The full InChI is InChI=1S/C51H32N2.C51H34N2.C45H28N2/c1-2-12-35(13-3-1)52-31-30-42-47(52)28-29-49-50(42)41-17-7-11-21-48(41)53(49)36-25-22-33(23-26-36)34-24-27-40-39-16-6-10-20-45(39)51(46(40)32-34)43-18-8-4-14-37(43)38-15-5-9-19-44(38)51;1-4-16-37(17-5-1)51(38-18-6-2-7-19-38)45-25-12-10-23-41(45)42-28-27-36(34-46(42)51)35-15-14-22-40(33-35)53-48-26-13-11-24-43(48)50-44-31-32-52(39-20-8-3-9-21-39)47(44)29-30-49(50)53;1-2-12-29(13-3-1)46-27-26-36-41(46)24-25-43-44(36)35-17-7-11-21-42(35)47(43)30-22-23-34-33-16-6-10-20-39(33)45(40(34)28-30)37-18-8-4-14-31(37)32-15-5-9-19-38(32)45/h1-32H;1-34H;1-28H.
What are the key properties of 6-[3-(9,9-diphenylfluoren-2-yl)phenyl]-3-phenylpyrrolo[2,3-c]carbazole;3-phenyl-6-[4-(9,9'-spirobi[fluorene]-2-yl)phenyl]pyrrolo[2,3-c]carbazole;3-phenyl-6-(9,9'-spirobi[fluorene]-2-yl)pyrrolo[2,3-c]carbazole?
6-[3-(9,9-diphenylfluoren-2-yl)phenyl]-3-phenylpyrrolo[2,3-c]carbazole;3-phenyl-6-[4-(9,9'-spirobi[fluorene]-2-yl)phenyl]pyrrolo[2,3-c]carbazole;3-phenyl-6-(9,9'-spirobi[fluorene]-2-yl)pyrrolo[2,3-c]carbazole has a molecular weight of 1944.41 g/mol, XLogP of 36.57, 10 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[3-(9,9-diphenylfluoren-2-yl)phenyl]-3-phenylpyrrolo[2,3-c]carbazole;3-phenyl-6-[4-(9,9'-spirobi[fluorene]-2-yl)phenyl]pyrrolo[2,3-c]carbazole;3-phenyl-6-(9,9'-spirobi[fluorene]-2-yl)pyrrolo[2,3-c]carbazole is sourced from PubChem (CID 161056569), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).