N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-N,9-bis(4-phenylphenyl)-6-trimethylsilylcarbazol-3-amine;N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-6-methoxy-N-(4-naphthalen-2-ylphenyl)-9-phenylcarbazol-3-amine;N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-6-(6-methyl-9-phenylcarbazol-3-yl)-N-naphthalen-2-ylpyridin-3-amine;N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-N-naphthalen-1-yl-9-phenyl-6-(5-phenylthiophen-2-yl)carbazol-3-amine

C230H175N9OSSi — CID 159425845

IUPACN-[4-(9,9-dimethylfluoren-2-yl)phenyl]-N,9-bis(4-phenylphenyl)-6-trimethylsilylcarbazol-3-amine;N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-6-methoxy-N-(4-naphthalen-2-ylphenyl)-9-phenylcarbazol-3-amine;N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-6-(6-methyl-9-phenylcarbazol-3-yl)-N-naphthalen-2-ylpyridin-3-amine;N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-N-naphthalen-1-yl-9-phenyl-6-(5-phenylthiophen-2-yl)carbazol-3-amine
SMILESCC1(C)c2ccccc2-c2ccc(-c3ccc(N(c4ccc(-c5ccccc5)cc4)c4ccc5c(c4)c4cc([Si](C)(C)C)ccc4n5-c4ccc(-c5ccccc5)cc4)cc3)cc21.CC1(C)c2ccccc2-c2ccc(-c3ccc(N(c4ccc5c(c4)c4cc(-c6ccc(-c7ccccc7)s6)ccc4n5-c4ccccc4)c4cccc5ccccc45)cc3)cc21.COc1ccc2c(c1)c1cc(N(c3ccc(-c4ccc5c(c4)C(C)(C)c4ccccc4-5)cc3)c3ccc(-c4ccc5ccccc5c4)cc3)ccc1n2-c1ccccc1.Cc1ccc2c(c1)c1cc(-c3ccc(N(c4ccc(-c5ccc6c(c5)C(C)(C)c5ccccc5-6)cc4)c4ccc5ccccc5c4)cn3)ccc1n2-c1ccccc1
InChIInChI=1S/C60H50N2Si.C59H42N2S.C56H42N2O.C55H41N3/c1-60(2)56-19-13-12-18-52(56)53-35-26-46(38-57(53)60)45-24-29-48(30-25-45)61(47-27-20-43(21-28-47)41-14-8-6-9-15-41)50-33-36-58-54(39-50)55-40-51(63(3,4)5)34-37-59(55)62(58)49-31-22-44(23-32-49)42-16-10-7-11-17-42;1-59(2)52-22-12-11-21-48(52)49-31-26-42(37-53(49)59)39-24-28-45(29-25-39)60(54-23-13-17-40-14-9-10-20-47(40)54)46-30-33-56-51(38-46)50-36-43(27-32-55(50)61(56)44-18-7-4-8-19-44)58-35-34-57(62-58)41-15-5-3-6-16-41;1-56(2)52-16-10-9-15-48(52)49-30-23-42(34-53(49)56)39-21-26-45(27-22-39)57(44-24-19-38(20-25-44)41-18-17-37-11-7-8-12-40(37)33-41)46-28-31-54-50(35-46)51-36-47(59-3)29-32-55(51)58(54)43-13-5-4-6-14-43;1-36-17-29-53-48(31-36)49-33-41(22-30-54(49)58(53)42-13-5-4-6-14-42)52-28-26-45(35-56-52)57(44-25-20-37-11-7-8-12-39(37)32-44)43-23-18-38(19-24-43)40-21-27-47-46-15-9-10-16-50(46)55(2,3)51(47)34-40/h6-40H,1-5H3;3-38H,1-2H3;4-36H,1-3H3;4-35H,1-3H3
InChIKeyLQIMMJWKDOZYIN-UHFFFAOYSA-N
MW3141.14 g/mol
LogP62.69
Rot. Bonds28

About N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-N,9-bis(4-phenylphenyl)-6-trimethylsilylcarbazol-3-amine;N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-6-methoxy-N-(4-naphthalen-2-ylphenyl)-9-phenylcarbazol-3-amine;N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-6-(6-methyl-9-phenylcarbazol-3-yl)-N-naphthalen-2-ylpyridin-3-amine;N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-N-naphthalen-1-yl-9-phenyl-6-(5-phenylthiophen-2-yl)carbazol-3-amine

N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-N,9-bis(4-phenylphenyl)-6-trimethylsilylcarbazol-3-amine;N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-6-methoxy-N-(4-naphthalen-2-ylphenyl)-9-phenylcarbazol-3-amine;N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-6-(6-methyl-9-phenylcarbazol-3-yl)-N-naphthalen-2-ylpyridin-3-amine;N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-N-naphthalen-1-yl-9-phenyl-6-(5-phenylthiophen-2-yl)carbazol-3-amine (PubChem CID 159425845) has the molecular formula C230H175N9OSSi and a molecular weight of 3141.14 g/mol. Its IUPAC name is N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-N,9-bis(4-phenylphenyl)-6-trimethylsilylcarbazol-3-amine;N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-6-methoxy-N-(4-naphthalen-2-ylphenyl)-9-phenylcarbazol-3-amine;N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-6-(6-methyl-9-phenylcarbazol-3-yl)-N-naphthalen-2-ylpyridin-3-amine;N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-N-naphthalen-1-yl-9-phenyl-6-(5-phenylthiophen-2-yl)carbazol-3-amine.

Molecular Properties

Compound NameN-[4-(9,9-dimethylfluoren-2-yl)phenyl]-N,9-bis(4-phenylphenyl)-6-trimethylsilylcarbazol-3-amine;N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-6-methoxy-N-(4-naphthalen-2-ylphenyl)-9-phenylcarbazol-3-amine;N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-6-(6-methyl-9-phenylcarbazol-3-yl)-N-naphthalen-2-ylpyridin-3-amine;N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-N-naphthalen-1-yl-9-phenyl-6-(5-phenylthiophen-2-yl)carbazol-3-amine
PubChem CID159425845
Molecular FormulaC230H175N9OSSi
Molecular Weight3141.14 g/mol
Exact Mass3138.34
IUPAC NameN-[4-(9,9-dimethylfluoren-2-yl)phenyl]-N,9-bis(4-phenylphenyl)-6-trimethylsilylcarbazol-3-amine;N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-6-methoxy-N-(4-naphthalen-2-ylphenyl)-9-phenylcarbazol-3-amine;N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-6-(6-methyl-9-phenylcarbazol-3-yl)-N-naphthalen-2-ylpyridin-3-amine;N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-N-naphthalen-1-yl-9-phenyl-6-(5-phenylthiophen-2-yl)carbazol-3-amine
SMILESCC1(C)c2ccccc2-c2ccc(-c3ccc(N(c4ccc(-c5ccccc5)cc4)c4ccc5c(c4)c4cc([Si](C)(C)C)ccc4n5-c4ccc(-c5ccccc5)cc4)cc3)cc21.CC1(C)c2ccccc2-c2ccc(-c3ccc(N(c4ccc5c(c4)c4cc(-c6ccc(-c7ccccc7)s6)ccc4n5-c4ccccc4)c4cccc5ccccc45)cc3)cc21.COc1ccc2c(c1)c1cc(N(c3ccc(-c4ccc5c(c4)C(C)(C)c4ccccc4-5)cc3)c3ccc(-c4ccc5ccccc5c4)cc3)ccc1n2-c1ccccc1.Cc1ccc2c(c1)c1cc(-c3ccc(N(c4ccc(-c5ccc6c(c5)C(C)(C)c5ccccc5-6)cc4)c4ccc5ccccc5c4)cn3)ccc1n2-c1ccccc1
InChIInChI=1S/C60H50N2Si.C59H42N2S.C56H42N2O.C55H41N3/c1-60(2)56-19-13-12-18-52(56)53-35-26-46(38-57(53)60)45-24-29-48(30-25-45)61(47-27-20-43(21-28-47)41-14-8-6-9-15-41)50-33-36-58-54(39-50)55-40-51(63(3,4)5)34-37-59(55)62(58)49-31-22-44(23-32-49)42-16-10-7-11-17-42;1-59(2)52-22-12-11-21-48(52)49-31-26-42(37-53(49)59)39-24-28-45(29-25-39)60(54-23-13-17-40-14-9-10-20-47(40)54)46-30-33-56-51(38-46)50-36-43(27-32-55(50)61(56)44-18-7-4-8-19-44)58-35-34-57(62-58)41-15-5-3-6-16-41;1-56(2)52-16-10-9-15-48(52)49-30-23-42(34-53(49)56)39-21-26-45(27-22-39)57(44-24-19-38(20-25-44)41-18-17-37-11-7-8-12-40(37)33-41)46-28-31-54-50(35-46)51-36-47(59-3)29-32-55(51)58(54)43-13-5-4-6-14-43;1-36-17-29-53-48(31-36)49-33-41(22-30-54(49)58(53)42-13-5-4-6-14-42)52-28-26-45(35-56-52)57(44-25-20-37-11-7-8-12-39(37)32-44)43-23-18-38(19-24-43)40-21-27-47-46-15-9-10-16-50(46)55(2,3)51(47)34-40/h6-40H,1-5H3;3-38H,1-2H3;4-36H,1-3H3;4-35H,1-3H3
InChIKeyLQIMMJWKDOZYIN-UHFFFAOYSA-N
XLogP62.69
TPSA54.80 Ų
H-Bond Donors
H-Bond Acceptors11
Rotatable Bonds28
Heavy Atoms242
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003141.14
LogP ≤ 562.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1011

Computed Properties (RDKit)

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

Analyze N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-N,9-bis(4-phenylphenyl)-6-trimethylsilylcarbazol-3-amine;N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-6-methoxy-N-(4-naphthalen-2-ylphenyl)-9-phenylcarbazol-3-amine;N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-6-(6-methyl-9-phenylcarbazol-3-yl)-N-naphthalen-2-ylpyridin-3-amine;N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-N-naphthalen-1-yl-9-phenyl-6-(5-phenylthiophen-2-yl)carbazol-3-amine with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-N,9-bis(4-phenylphenyl)-6-trimethylsilylcarbazol-3-amine;N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-6-methoxy-N-(4-naphthalen-2-ylphenyl)-9-phenylcarbazol-3-amine;N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-6-(6-methyl-9-phenylcarbazol-3-yl)-N-naphthalen-2-ylpyridin-3-amine;N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-N-naphthalen-1-yl-9-phenyl-6-(5-phenylthiophen-2-yl)carbazol-3-amine?
The IUPAC name of N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-N,9-bis(4-phenylphenyl)-6-trimethylsilylcarbazol-3-amine;N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-6-methoxy-N-(4-naphthalen-2-ylphenyl)-9-phenylcarbazol-3-amine;N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-6-(6-methyl-9-phenylcarbazol-3-yl)-N-naphthalen-2-ylpyridin-3-amine;N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-N-naphthalen-1-yl-9-phenyl-6-(5-phenylthiophen-2-yl)carbazol-3-amine (CID 159425845) is N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-N,9-bis(4-phenylphenyl)-6-trimethylsilylcarbazol-3-amine;N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-6-methoxy-N-(4-naphthalen-2-ylphenyl)-9-phenylcarbazol-3-amine;N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-6-(6-methyl-9-phenylcarbazol-3-yl)-N-naphthalen-2-ylpyridin-3-amine;N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-N-naphthalen-1-yl-9-phenyl-6-(5-phenylthiophen-2-yl)carbazol-3-amine.
What is the SMILES notation for N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-N,9-bis(4-phenylphenyl)-6-trimethylsilylcarbazol-3-amine;N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-6-methoxy-N-(4-naphthalen-2-ylphenyl)-9-phenylcarbazol-3-amine;N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-6-(6-methyl-9-phenylcarbazol-3-yl)-N-naphthalen-2-ylpyridin-3-amine;N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-N-naphthalen-1-yl-9-phenyl-6-(5-phenylthiophen-2-yl)carbazol-3-amine?
The canonical SMILES for N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-N,9-bis(4-phenylphenyl)-6-trimethylsilylcarbazol-3-amine;N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-6-methoxy-N-(4-naphthalen-2-ylphenyl)-9-phenylcarbazol-3-amine;N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-6-(6-methyl-9-phenylcarbazol-3-yl)-N-naphthalen-2-ylpyridin-3-amine;N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-N-naphthalen-1-yl-9-phenyl-6-(5-phenylthiophen-2-yl)carbazol-3-amine is CC1(C)c2ccccc2-c2ccc(-c3ccc(N(c4ccc(-c5ccccc5)cc4)c4ccc5c(c4)c4cc([Si](C)(C)C)ccc4n5-c4ccc(-c5ccccc5)cc4)cc3)cc21.CC1(C)c2ccccc2-c2ccc(-c3ccc(N(c4ccc5c(c4)c4cc(-c6ccc(-c7ccccc7)s6)ccc4n5-c4ccccc4)c4cccc5ccccc45)cc3)cc21.COc1ccc2c(c1)c1cc(N(c3ccc(-c4ccc5c(c4)C(C)(C)c4ccccc4-5)cc3)c3ccc(-c4ccc5ccccc5c4)cc3)ccc1n2-c1ccccc1.Cc1ccc2c(c1)c1cc(-c3ccc(N(c4ccc(-c5ccc6c(c5)C(C)(C)c5ccccc5-6)cc4)c4ccc5ccccc5c4)cn3)ccc1n2-c1ccccc1.
What is the InChIKey of N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-N,9-bis(4-phenylphenyl)-6-trimethylsilylcarbazol-3-amine;N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-6-methoxy-N-(4-naphthalen-2-ylphenyl)-9-phenylcarbazol-3-amine;N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-6-(6-methyl-9-phenylcarbazol-3-yl)-N-naphthalen-2-ylpyridin-3-amine;N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-N-naphthalen-1-yl-9-phenyl-6-(5-phenylthiophen-2-yl)carbazol-3-amine?
The InChIKey is LQIMMJWKDOZYIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C60H50N2Si.C59H42N2S.C56H42N2O.C55H41N3/c1-60(2)56-19-13-12-18-52(56)53-35-26-46(38-57(53)60)45-24-29-48(30-25-45)61(47-27-20-43(21-28-47)41-14-8-6-9-15-41)50-33-36-58-54(39-50)55-40-51(63(3,4)5)34-37-59(55)62(58)49-31-22-44(23-32-49)42-16-10-7-11-17-42;1-59(2)52-22-12-11-21-48(52)49-31-26-42(37-53(49)59)39-24-28-45(29-25-39)60(54-23-13-17-40-14-9-10-20-47(40)54)46-30-33-56-51(38-46)50-36-43(27-32-55(50)61(56)44-18-7-4-8-19-44)58-35-34-57(62-58)41-15-5-3-6-16-41;1-56(2)52-16-10-9-15-48(52)49-30-23-42(34-53(49)56)39-21-26-45(27-22-39)57(44-24-19-38(20-25-44)41-18-17-37-11-7-8-12-40(37)33-41)46-28-31-54-50(35-46)51-36-47(59-3)29-32-55(51)58(54)43-13-5-4-6-14-43;1-36-17-29-53-48(31-36)49-33-41(22-30-54(49)58(53)42-13-5-4-6-14-42)52-28-26-45(35-56-52)57(44-25-20-37-11-7-8-12-39(37)32-44)43-23-18-38(19-24-43)40-21-27-47-46-15-9-10-16-50(46)55(2,3)51(47)34-40/h6-40H,1-5H3;3-38H,1-2H3;4-36H,1-3H3;4-35H,1-3H3.
What are the key properties of N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-N,9-bis(4-phenylphenyl)-6-trimethylsilylcarbazol-3-amine;N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-6-methoxy-N-(4-naphthalen-2-ylphenyl)-9-phenylcarbazol-3-amine;N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-6-(6-methyl-9-phenylcarbazol-3-yl)-N-naphthalen-2-ylpyridin-3-amine;N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-N-naphthalen-1-yl-9-phenyl-6-(5-phenylthiophen-2-yl)carbazol-3-amine?
N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-N,9-bis(4-phenylphenyl)-6-trimethylsilylcarbazol-3-amine;N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-6-methoxy-N-(4-naphthalen-2-ylphenyl)-9-phenylcarbazol-3-amine;N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-6-(6-methyl-9-phenylcarbazol-3-yl)-N-naphthalen-2-ylpyridin-3-amine;N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-N-naphthalen-1-yl-9-phenyl-6-(5-phenylthiophen-2-yl)carbazol-3-amine has a molecular weight of 3141.14 g/mol, XLogP of 62.69, 28 rotatable bonds, 0 hydrogen bond donors, and 11 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-N,9-bis(4-phenylphenyl)-6-trimethylsilylcarbazol-3-amine;N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-6-methoxy-N-(4-naphthalen-2-ylphenyl)-9-phenylcarbazol-3-amine;N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-6-(6-methyl-9-phenylcarbazol-3-yl)-N-naphthalen-2-ylpyridin-3-amine;N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-N-naphthalen-1-yl-9-phenyl-6-(5-phenylthiophen-2-yl)carbazol-3-amine is sourced from PubChem (CID 159425845), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).