N-dibenzofuran-2-yl-12-phenyl-N-(9,9'-spirobi[fluorene]-4-yl)-[1]benzofuro[3,2-a]carbazol-9-amine;N-(9,9-dimethylfluoren-2-yl)-12-phenyl-N-(9,9'-spirobi[fluorene]-4-yl)-[1]benzofuro[3,2-a]carbazol-9-amine;5-phenyl-N-(2-phenylphenyl)-N-(9,9'-spirobi[fluorene]-4-yl)-[1]benzofuro[3,2-c]carbazol-2-amine

C186H116N6O4 — CID 159897367

IUPACN-dibenzofuran-2-yl-12-phenyl-N-(9,9'-spirobi[fluorene]-4-yl)-[1]benzofuro[3,2-a]carbazol-9-amine;N-(9,9-dimethylfluoren-2-yl)-12-phenyl-N-(9,9'-spirobi[fluorene]-4-yl)-[1]benzofuro[3,2-a]carbazol-9-amine;5-phenyl-N-(2-phenylphenyl)-N-(9,9'-spirobi[fluorene]-4-yl)-[1]benzofuro[3,2-c]carbazol-2-amine
SMILESCC1(C)c2ccccc2-c2ccc(N(c3ccc4c(c3)c3ccc5oc6ccccc6c5c3n4-c3ccccc3)c3cccc4c3-c3ccccc3C43c4ccccc4-c4ccccc43)cc21.c1ccc(-c2ccccc2N(c2ccc3c(c2)c2c4oc5ccccc5c4ccc2n3-c2ccccc2)c2cccc3c2-c2ccccc2C32c3ccccc3-c3ccccc32)cc1.c1ccc(-n2c3ccc(N(c4ccc5oc6ccccc6c5c4)c4cccc5c4-c4ccccc4C54c5ccccc5-c5ccccc54)cc3c3ccc4oc5ccccc5c4c32)cc1
InChIInChI=1S/C64H42N2O.C61H36N2O2.C61H38N2O/c1-63(2)50-24-11-6-19-42(50)45-33-31-41(38-55(45)63)65(57-29-16-28-54-60(57)47-22-9-14-27-53(47)64(54)51-25-12-7-20-43(51)44-21-8-13-26-52(44)64)40-32-35-56-49(37-40)46-34-36-59-61(48-23-10-15-30-58(48)67-59)62(46)66(56)39-17-4-3-5-18-39;1-2-15-37(16-3-1)63-52-32-29-38(35-46(52)43-31-34-57-59(60(43)63)45-21-8-13-28-55(45)65-57)62(39-30-33-56-47(36-39)42-19-7-12-27-54(42)64-56)53-26-14-25-51-58(53)44-20-6-11-24-50(44)61(51)48-22-9-4-17-40(48)41-18-5-10-23-49(41)61;1-3-18-39(19-4-1)42-22-10-15-31-53(42)63(55-32-17-30-52-58(55)47-26-9-14-29-51(47)61(52)49-27-12-7-23-43(49)44-24-8-13-28-50(44)61)41-34-36-54-48(38-41)59-56(62(54)40-20-5-2-6-21-40)37-35-46-45-25-11-16-33-57(45)64-60(46)59/h3-38H,1-2H3;1-36H;1-38H
InChIKeyNVMZKJCYYOHUAW-UHFFFAOYSA-N
MW2499.01 g/mol
LogP49.36
Rot. Bonds13

About N-dibenzofuran-2-yl-12-phenyl-N-(9,9'-spirobi[fluorene]-4-yl)-[1]benzofuro[3,2-a]carbazol-9-amine;N-(9,9-dimethylfluoren-2-yl)-12-phenyl-N-(9,9'-spirobi[fluorene]-4-yl)-[1]benzofuro[3,2-a]carbazol-9-amine;5-phenyl-N-(2-phenylphenyl)-N-(9,9'-spirobi[fluorene]-4-yl)-[1]benzofuro[3,2-c]carbazol-2-amine

N-dibenzofuran-2-yl-12-phenyl-N-(9,9'-spirobi[fluorene]-4-yl)-[1]benzofuro[3,2-a]carbazol-9-amine;N-(9,9-dimethylfluoren-2-yl)-12-phenyl-N-(9,9'-spirobi[fluorene]-4-yl)-[1]benzofuro[3,2-a]carbazol-9-amine;5-phenyl-N-(2-phenylphenyl)-N-(9,9'-spirobi[fluorene]-4-yl)-[1]benzofuro[3,2-c]carbazol-2-amine (PubChem CID 159897367) has the molecular formula C186H116N6O4 and a molecular weight of 2499.01 g/mol. Its IUPAC name is N-dibenzofuran-2-yl-12-phenyl-N-(9,9'-spirobi[fluorene]-4-yl)-[1]benzofuro[3,2-a]carbazol-9-amine;N-(9,9-dimethylfluoren-2-yl)-12-phenyl-N-(9,9'-spirobi[fluorene]-4-yl)-[1]benzofuro[3,2-a]carbazol-9-amine;5-phenyl-N-(2-phenylphenyl)-N-(9,9'-spirobi[fluorene]-4-yl)-[1]benzofuro[3,2-c]carbazol-2-amine.

Molecular Properties

Compound NameN-dibenzofuran-2-yl-12-phenyl-N-(9,9'-spirobi[fluorene]-4-yl)-[1]benzofuro[3,2-a]carbazol-9-amine;N-(9,9-dimethylfluoren-2-yl)-12-phenyl-N-(9,9'-spirobi[fluorene]-4-yl)-[1]benzofuro[3,2-a]carbazol-9-amine;5-phenyl-N-(2-phenylphenyl)-N-(9,9'-spirobi[fluorene]-4-yl)-[1]benzofuro[3,2-c]carbazol-2-amine
PubChem CID159897367
Molecular FormulaC186H116N6O4
Molecular Weight2499.01 g/mol
Exact Mass2496.91
IUPAC NameN-dibenzofuran-2-yl-12-phenyl-N-(9,9'-spirobi[fluorene]-4-yl)-[1]benzofuro[3,2-a]carbazol-9-amine;N-(9,9-dimethylfluoren-2-yl)-12-phenyl-N-(9,9'-spirobi[fluorene]-4-yl)-[1]benzofuro[3,2-a]carbazol-9-amine;5-phenyl-N-(2-phenylphenyl)-N-(9,9'-spirobi[fluorene]-4-yl)-[1]benzofuro[3,2-c]carbazol-2-amine
SMILESCC1(C)c2ccccc2-c2ccc(N(c3ccc4c(c3)c3ccc5oc6ccccc6c5c3n4-c3ccccc3)c3cccc4c3-c3ccccc3C43c4ccccc4-c4ccccc43)cc21.c1ccc(-c2ccccc2N(c2ccc3c(c2)c2c4oc5ccccc5c4ccc2n3-c2ccccc2)c2cccc3c2-c2ccccc2C32c3ccccc3-c3ccccc32)cc1.c1ccc(-n2c3ccc(N(c4ccc5oc6ccccc6c5c4)c4cccc5c4-c4ccccc4C54c5ccccc5-c5ccccc54)cc3c3ccc4oc5ccccc5c4c32)cc1
InChIInChI=1S/C64H42N2O.C61H36N2O2.C61H38N2O/c1-63(2)50-24-11-6-19-42(50)45-33-31-41(38-55(45)63)65(57-29-16-28-54-60(57)47-22-9-14-27-53(47)64(54)51-25-12-7-20-43(51)44-21-8-13-26-52(44)64)40-32-35-56-49(37-40)46-34-36-59-61(48-23-10-15-30-58(48)67-59)62(46)66(56)39-17-4-3-5-18-39;1-2-15-37(16-3-1)63-52-32-29-38(35-46(52)43-31-34-57-59(60(43)63)45-21-8-13-28-55(45)65-57)62(39-30-33-56-47(36-39)42-19-7-12-27-54(42)64-56)53-26-14-25-51-58(53)44-20-6-11-24-50(44)61(51)48-22-9-4-17-40(48)41-18-5-10-23-49(41)61;1-3-18-39(19-4-1)42-22-10-15-31-53(42)63(55-32-17-30-52-58(55)47-26-9-14-29-51(47)61(52)49-27-12-7-23-43(49)44-24-8-13-28-50(44)61)41-34-36-54-48(38-41)59-56(62(54)40-20-5-2-6-21-40)37-35-46-45-25-11-16-33-57(45)64-60(46)59/h3-38H,1-2H3;1-36H;1-38H
InChIKeyNVMZKJCYYOHUAW-UHFFFAOYSA-N
XLogP49.36
TPSA77.07 Ų
H-Bond Donors
H-Bond Acceptors10
Rotatable Bonds13
Heavy Atoms196
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002499.01
LogP ≤ 549.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1010

Analyze N-dibenzofuran-2-yl-12-phenyl-N-(9,9'-spirobi[fluorene]-4-yl)-[1]benzofuro[3,2-a]carbazol-9-amine;N-(9,9-dimethylfluoren-2-yl)-12-phenyl-N-(9,9'-spirobi[fluorene]-4-yl)-[1]benzofuro[3,2-a]carbazol-9-amine;5-phenyl-N-(2-phenylphenyl)-N-(9,9'-spirobi[fluorene]-4-yl)-[1]benzofuro[3,2-c]carbazol-2-amine with MolForge

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Related Compounds

N-(9,9-dimethylfluoren-4-yl)-5-phenyl-N-(9,9'-spirobi[fluorene]-4-yl)-[1]benzofuro[2,3-g]carbazol-3-amine
CID 146332893
N-(4-dibenzofuran-1-ylphenyl)-N-(4-phenylphenyl)-9,9'-spirobi[fluorene]-4-amine;9-phenyl-N-(2-phenylphenyl)-N-(9,9'-spirobi[fluorene]-4-yl)carbazol-3-amine;9-phenyl-N-(4-phenylphenyl)-N-(9,9'-spirobi[fluorene]-4-yl)carbazol-3-amine
CID 165022817
N-(9,9-dimethylfluoren-2-yl)-18-phenyl-N-(9,9'-spirobi[fluorene]-4-yl)-10,20-dioxapentacyclo[11.7.0.03,11.04,9.014,19]icosa-1,3(11),4(9),5,7,12,14(19),15,17-nonaen-6-amine
CID 171050271
N-naphtho[2,1-b][1]benzofuran-10-yl-5-phenyl-N-(9,9'-spirobi[fluorene]-4-yl)-[1]benzofuro[2,3-g]carbazol-3-amine
CID 146333021
N,N-bis(4-phenylphenyl)-9,9'-spirobi[fluorene]-4-amine;N-(9,9-dimethylfluoren-2-yl)-N-(4-phenylphenyl)-9,9'-spirobi[fluorene]-4-amine;N-(9,9-dimethylfluoren-2-yl)-N-(9,9'-spirobi[fluorene]-4-yl)dibenzofuran-2-amine;N-(4-phenylphenyl)-N-(9,9'-spirobi[fluorene]-4-yl)dibenzofuran-2-amine
CID 164990095
N-(4-dibenzofuran-2-ylphenyl)-N-(9,9-dimethylfluoren-2-yl)-10-phenylspiro[acridine-9,9'-fluorene]-4'-amine;N-(4-dibenzofuran-4-ylphenyl)-N-(9,9-dimethylfluoren-2-yl)-10-phenylspiro[acridine-9,9'-fluorene]-4'-amine;N-(4-dibenzofuran-2-ylphenyl)-N-(4-phenylphenyl)spiro[1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene-13,9'-fluorene]-4'-amine
CID 159413400
N-dibenzofuran-2-yl-8-(9-phenylcarbazol-3-yl)-N-(4-phenylphenyl)dibenzofuran-1-amine;N-(4-dibenzofuran-4-ylphenyl)-N-(9,9-dimethylfluoren-4-yl)-8-(9-phenylcarbazol-3-yl)dibenzofuran-1-amine;N-(9,9-dimethylfluoren-4-yl)-8-(9-phenylcarbazol-1-yl)-N-(4-phenylphenyl)dibenzofuran-1-amine;N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-8-(9-phenylcarbazol-3-yl)-N-(4-phenylphenyl)dibenzofuran-1-amine;N-(9,9-dimethylfluoren-2-yl)-2-phenyl-8-(9-phenylcarbazol-3-yl)-N-(4-phenylphenyl)dibenzofuran-1-amine
CID 164949538
N-(4-dibenzofuran-2-ylphenyl)-N-triphenylen-2-ylspiro[1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene-13,9'-fluorene]-4'-amine;N-(4-dibenzofuran-4-ylphenyl)-N-triphenylen-2-ylspiro[1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene-13,9'-fluorene]-4'-amine;N-(9,9-dimethylfluoren-2-yl)-N-triphenylen-2-ylspiro[1-azapentacyclo[10.7.1.02,7.08,20.014,19]icosa-2,4,6,8(20),9,11,14,16,18-nonaene-13,9'-fluorene]-4'-amine
CID 157126785
N-(9,9-dimethylfluoren-2-yl)-N-phenyl-5-[4-(N-phenylanilino)phenyl]-[1]benzofuro[3,2-c]carbazol-2-amine
CID 90050684
N-(4-carbazol-9-ylphenyl)-4-phenyl-N-[4-(9,9'-spirobi[fluorene]-4'-yl)phenyl]aniline;9,9-dimethyl-N-(4-phenylphenyl)-N-[4-(9,9'-spirobi[fluorene]-4'-yl)phenyl]fluoren-2-amine;N-(4-phenylphenyl)-N-[4-(9,9'-spirobi[fluorene]-4'-yl)phenyl]dibenzofuran-2-amine
CID 165075228
N-(4-dibenzofuran-4-ylphenyl)-9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]fluoren-2-amine;N-(4-dibenzofuran-4-ylphenyl)-9,9-diphenyl-N-(4-phenylphenyl)fluoren-4-amine;N-(9,9-dimethylfluoren-4-yl)-N-(4-phenylphenyl)dibenzofuran-4-amine
CID 160755844
N-(9,9-dimethylfluoren-4-yl)-N-[4-[8-[9,9-dimethyl-7-[N-[8-(9-phenylcarbazol-3-yl)dibenzofuran-2-yl]-4-(4-phenylphenyl)anilino]fluoren-3-yl]dibenzofuran-4-yl]phenyl]-8-(9-phenylcarbazol-3-yl)dibenzofuran-1-amine
CID 167095022

Frequently Asked Questions

What is the IUPAC name of N-dibenzofuran-2-yl-12-phenyl-N-(9,9'-spirobi[fluorene]-4-yl)-[1]benzofuro[3,2-a]carbazol-9-amine;N-(9,9-dimethylfluoren-2-yl)-12-phenyl-N-(9,9'-spirobi[fluorene]-4-yl)-[1]benzofuro[3,2-a]carbazol-9-amine;5-phenyl-N-(2-phenylphenyl)-N-(9,9'-spirobi[fluorene]-4-yl)-[1]benzofuro[3,2-c]carbazol-2-amine?
The IUPAC name of N-dibenzofuran-2-yl-12-phenyl-N-(9,9'-spirobi[fluorene]-4-yl)-[1]benzofuro[3,2-a]carbazol-9-amine;N-(9,9-dimethylfluoren-2-yl)-12-phenyl-N-(9,9'-spirobi[fluorene]-4-yl)-[1]benzofuro[3,2-a]carbazol-9-amine;5-phenyl-N-(2-phenylphenyl)-N-(9,9'-spirobi[fluorene]-4-yl)-[1]benzofuro[3,2-c]carbazol-2-amine (CID 159897367) is N-dibenzofuran-2-yl-12-phenyl-N-(9,9'-spirobi[fluorene]-4-yl)-[1]benzofuro[3,2-a]carbazol-9-amine;N-(9,9-dimethylfluoren-2-yl)-12-phenyl-N-(9,9'-spirobi[fluorene]-4-yl)-[1]benzofuro[3,2-a]carbazol-9-amine;5-phenyl-N-(2-phenylphenyl)-N-(9,9'-spirobi[fluorene]-4-yl)-[1]benzofuro[3,2-c]carbazol-2-amine.
What is the SMILES notation for N-dibenzofuran-2-yl-12-phenyl-N-(9,9'-spirobi[fluorene]-4-yl)-[1]benzofuro[3,2-a]carbazol-9-amine;N-(9,9-dimethylfluoren-2-yl)-12-phenyl-N-(9,9'-spirobi[fluorene]-4-yl)-[1]benzofuro[3,2-a]carbazol-9-amine;5-phenyl-N-(2-phenylphenyl)-N-(9,9'-spirobi[fluorene]-4-yl)-[1]benzofuro[3,2-c]carbazol-2-amine?
The canonical SMILES for N-dibenzofuran-2-yl-12-phenyl-N-(9,9'-spirobi[fluorene]-4-yl)-[1]benzofuro[3,2-a]carbazol-9-amine;N-(9,9-dimethylfluoren-2-yl)-12-phenyl-N-(9,9'-spirobi[fluorene]-4-yl)-[1]benzofuro[3,2-a]carbazol-9-amine;5-phenyl-N-(2-phenylphenyl)-N-(9,9'-spirobi[fluorene]-4-yl)-[1]benzofuro[3,2-c]carbazol-2-amine is CC1(C)c2ccccc2-c2ccc(N(c3ccc4c(c3)c3ccc5oc6ccccc6c5c3n4-c3ccccc3)c3cccc4c3-c3ccccc3C43c4ccccc4-c4ccccc43)cc21.c1ccc(-c2ccccc2N(c2ccc3c(c2)c2c4oc5ccccc5c4ccc2n3-c2ccccc2)c2cccc3c2-c2ccccc2C32c3ccccc3-c3ccccc32)cc1.c1ccc(-n2c3ccc(N(c4ccc5oc6ccccc6c5c4)c4cccc5c4-c4ccccc4C54c5ccccc5-c5ccccc54)cc3c3ccc4oc5ccccc5c4c32)cc1.
What is the InChIKey of N-dibenzofuran-2-yl-12-phenyl-N-(9,9'-spirobi[fluorene]-4-yl)-[1]benzofuro[3,2-a]carbazol-9-amine;N-(9,9-dimethylfluoren-2-yl)-12-phenyl-N-(9,9'-spirobi[fluorene]-4-yl)-[1]benzofuro[3,2-a]carbazol-9-amine;5-phenyl-N-(2-phenylphenyl)-N-(9,9'-spirobi[fluorene]-4-yl)-[1]benzofuro[3,2-c]carbazol-2-amine?
The InChIKey is NVMZKJCYYOHUAW-UHFFFAOYSA-N. The full InChI is InChI=1S/C64H42N2O.C61H36N2O2.C61H38N2O/c1-63(2)50-24-11-6-19-42(50)45-33-31-41(38-55(45)63)65(57-29-16-28-54-60(57)47-22-9-14-27-53(47)64(54)51-25-12-7-20-43(51)44-21-8-13-26-52(44)64)40-32-35-56-49(37-40)46-34-36-59-61(48-23-10-15-30-58(48)67-59)62(46)66(56)39-17-4-3-5-18-39;1-2-15-37(16-3-1)63-52-32-29-38(35-46(52)43-31-34-57-59(60(43)63)45-21-8-13-28-55(45)65-57)62(39-30-33-56-47(36-39)42-19-7-12-27-54(42)64-56)53-26-14-25-51-58(53)44-20-6-11-24-50(44)61(51)48-22-9-4-17-40(48)41-18-5-10-23-49(41)61;1-3-18-39(19-4-1)42-22-10-15-31-53(42)63(55-32-17-30-52-58(55)47-26-9-14-29-51(47)61(52)49-27-12-7-23-43(49)44-24-8-13-28-50(44)61)41-34-36-54-48(38-41)59-56(62(54)40-20-5-2-6-21-40)37-35-46-45-25-11-16-33-57(45)64-60(46)59/h3-38H,1-2H3;1-36H;1-38H.
What are the key properties of N-dibenzofuran-2-yl-12-phenyl-N-(9,9'-spirobi[fluorene]-4-yl)-[1]benzofuro[3,2-a]carbazol-9-amine;N-(9,9-dimethylfluoren-2-yl)-12-phenyl-N-(9,9'-spirobi[fluorene]-4-yl)-[1]benzofuro[3,2-a]carbazol-9-amine;5-phenyl-N-(2-phenylphenyl)-N-(9,9'-spirobi[fluorene]-4-yl)-[1]benzofuro[3,2-c]carbazol-2-amine?
N-dibenzofuran-2-yl-12-phenyl-N-(9,9'-spirobi[fluorene]-4-yl)-[1]benzofuro[3,2-a]carbazol-9-amine;N-(9,9-dimethylfluoren-2-yl)-12-phenyl-N-(9,9'-spirobi[fluorene]-4-yl)-[1]benzofuro[3,2-a]carbazol-9-amine;5-phenyl-N-(2-phenylphenyl)-N-(9,9'-spirobi[fluorene]-4-yl)-[1]benzofuro[3,2-c]carbazol-2-amine has a molecular weight of 2499.01 g/mol, XLogP of 49.36, 13 rotatable bonds, 0 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for N-dibenzofuran-2-yl-12-phenyl-N-(9,9'-spirobi[fluorene]-4-yl)-[1]benzofuro[3,2-a]carbazol-9-amine;N-(9,9-dimethylfluoren-2-yl)-12-phenyl-N-(9,9'-spirobi[fluorene]-4-yl)-[1]benzofuro[3,2-a]carbazol-9-amine;5-phenyl-N-(2-phenylphenyl)-N-(9,9'-spirobi[fluorene]-4-yl)-[1]benzofuro[3,2-c]carbazol-2-amine is sourced from PubChem (CID 159897367), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).