N-(4-dibenzothiophen-4-ylphenyl)-N-(9,9-dimethylfluoren-4-yl)dibenzofuran-1-amine;N-(9,9-dimethylfluoren-4-yl)-N-[2-(9,9-dimethylfluoren-2-yl)phenyl]dibenzofuran-1-amine;N-(9,9-dimethylfluoren-4-yl)-8-phenyl-N-(4-phenylphenyl)dibenzofuran-1-amine;N-(9,9-dimethylfluoren-4-yl)-N-triphenylen-2-yldibenzofuran-1-amine

C183H132N4O4S — CID 160970830

IUPACN-(4-dibenzothiophen-4-ylphenyl)-N-(9,9-dimethylfluoren-4-yl)dibenzofuran-1-amine;N-(9,9-dimethylfluoren-4-yl)-N-[2-(9,9-dimethylfluoren-2-yl)phenyl]dibenzofuran-1-amine;N-(9,9-dimethylfluoren-4-yl)-8-phenyl-N-(4-phenylphenyl)dibenzofuran-1-amine;N-(9,9-dimethylfluoren-4-yl)-N-triphenylen-2-yldibenzofuran-1-amine
SMILESCC1(C)c2ccccc2-c2c(N(c3ccc(-c4cccc5c4sc4ccccc45)cc3)c3cccc4oc5ccccc5c34)cccc21.CC1(C)c2ccccc2-c2c(N(c3ccc(-c4ccccc4)cc3)c3cccc4oc5ccc(-c6ccccc6)cc5c34)cccc21.CC1(C)c2ccccc2-c2c(N(c3ccc4c5ccccc5c5ccccc5c4c3)c3cccc4oc5ccccc5c34)cccc21.CC1(C)c2ccccc2-c2ccc(-c3ccccc3N(c3cccc4c3-c3ccccc3C4(C)C)c3cccc4oc5ccccc5c34)cc21
InChIInChI=1S/C48H37NO.C45H31NOS.C45H31NO.C45H33NO/c1-47(2)37-20-10-6-17-34(37)45-38(47)21-13-23-41(45)49(42-24-14-26-44-46(42)35-18-8-12-25-43(35)50-44)40-22-11-7-15-31(40)30-27-28-33-32-16-5-9-19-36(32)48(3,4)39(33)29-30;1-45(2)35-17-6-3-13-33(35)42-36(45)18-10-19-37(42)46(38-20-11-22-40-43(38)34-14-4-7-21-39(34)47-40)29-26-24-28(25-27-29)30-15-9-16-32-31-12-5-8-23-41(31)48-44(30)32;1-45(2)37-19-9-7-17-34(37)43-38(45)20-11-21-39(43)46(40-22-12-24-42-44(40)35-18-8-10-23-41(35)47-42)28-25-26-33-31-15-4-3-13-29(31)30-14-5-6-16-32(30)36(33)27-28;1-45(2)37-18-10-9-17-35(37)43-38(45)19-11-20-39(43)46(34-26-23-32(24-27-34)30-13-5-3-6-14-30)40-21-12-22-42-44(40)36-29-33(25-28-41(36)47-42)31-15-7-4-8-16-31/h5-29H,1-4H3;3-27H,1-2H3;3-27H,1-2H3;3-29H,1-2H3
InChIKeySYFPDVVXLGOHEV-UHFFFAOYSA-N
MW2483.16 g/mol
LogP52.25
Rot. Bonds16

About N-(4-dibenzothiophen-4-ylphenyl)-N-(9,9-dimethylfluoren-4-yl)dibenzofuran-1-amine;N-(9,9-dimethylfluoren-4-yl)-N-[2-(9,9-dimethylfluoren-2-yl)phenyl]dibenzofuran-1-amine;N-(9,9-dimethylfluoren-4-yl)-8-phenyl-N-(4-phenylphenyl)dibenzofuran-1-amine;N-(9,9-dimethylfluoren-4-yl)-N-triphenylen-2-yldibenzofuran-1-amine

N-(4-dibenzothiophen-4-ylphenyl)-N-(9,9-dimethylfluoren-4-yl)dibenzofuran-1-amine;N-(9,9-dimethylfluoren-4-yl)-N-[2-(9,9-dimethylfluoren-2-yl)phenyl]dibenzofuran-1-amine;N-(9,9-dimethylfluoren-4-yl)-8-phenyl-N-(4-phenylphenyl)dibenzofuran-1-amine;N-(9,9-dimethylfluoren-4-yl)-N-triphenylen-2-yldibenzofuran-1-amine (PubChem CID 160970830) has the molecular formula C183H132N4O4S and a molecular weight of 2483.16 g/mol. Its IUPAC name is N-(4-dibenzothiophen-4-ylphenyl)-N-(9,9-dimethylfluoren-4-yl)dibenzofuran-1-amine;N-(9,9-dimethylfluoren-4-yl)-N-[2-(9,9-dimethylfluoren-2-yl)phenyl]dibenzofuran-1-amine;N-(9,9-dimethylfluoren-4-yl)-8-phenyl-N-(4-phenylphenyl)dibenzofuran-1-amine;N-(9,9-dimethylfluoren-4-yl)-N-triphenylen-2-yldibenzofuran-1-amine.

Molecular Properties

Compound NameN-(4-dibenzothiophen-4-ylphenyl)-N-(9,9-dimethylfluoren-4-yl)dibenzofuran-1-amine;N-(9,9-dimethylfluoren-4-yl)-N-[2-(9,9-dimethylfluoren-2-yl)phenyl]dibenzofuran-1-amine;N-(9,9-dimethylfluoren-4-yl)-8-phenyl-N-(4-phenylphenyl)dibenzofuran-1-amine;N-(9,9-dimethylfluoren-4-yl)-N-triphenylen-2-yldibenzofuran-1-amine
PubChem CID160970830
Molecular FormulaC183H132N4O4S
Molecular Weight2483.16 g/mol
Exact Mass2481.00
IUPAC NameN-(4-dibenzothiophen-4-ylphenyl)-N-(9,9-dimethylfluoren-4-yl)dibenzofuran-1-amine;N-(9,9-dimethylfluoren-4-yl)-N-[2-(9,9-dimethylfluoren-2-yl)phenyl]dibenzofuran-1-amine;N-(9,9-dimethylfluoren-4-yl)-8-phenyl-N-(4-phenylphenyl)dibenzofuran-1-amine;N-(9,9-dimethylfluoren-4-yl)-N-triphenylen-2-yldibenzofuran-1-amine
SMILESCC1(C)c2ccccc2-c2c(N(c3ccc(-c4cccc5c4sc4ccccc45)cc3)c3cccc4oc5ccccc5c34)cccc21.CC1(C)c2ccccc2-c2c(N(c3ccc(-c4ccccc4)cc3)c3cccc4oc5ccc(-c6ccccc6)cc5c34)cccc21.CC1(C)c2ccccc2-c2c(N(c3ccc4c5ccccc5c5ccccc5c4c3)c3cccc4oc5ccccc5c34)cccc21.CC1(C)c2ccccc2-c2ccc(-c3ccccc3N(c3cccc4c3-c3ccccc3C4(C)C)c3cccc4oc5ccccc5c34)cc21
InChIInChI=1S/C48H37NO.C45H31NOS.C45H31NO.C45H33NO/c1-47(2)37-20-10-6-17-34(37)45-38(47)21-13-23-41(45)49(42-24-14-26-44-46(42)35-18-8-12-25-43(35)50-44)40-22-11-7-15-31(40)30-27-28-33-32-16-5-9-19-36(32)48(3,4)39(33)29-30;1-45(2)35-17-6-3-13-33(35)42-36(45)18-10-19-37(42)46(38-20-11-22-40-43(38)34-14-4-7-21-39(34)47-40)29-26-24-28(25-27-29)30-15-9-16-32-31-12-5-8-23-41(31)48-44(30)32;1-45(2)37-19-9-7-17-34(37)43-38(45)20-11-21-39(43)46(40-22-12-24-42-44(40)35-18-8-10-23-41(35)47-42)28-25-26-33-31-15-4-3-13-29(31)30-14-5-6-16-32(30)36(33)27-28;1-45(2)37-18-10-9-17-35(37)43-38(45)19-11-20-39(43)46(34-26-23-32(24-27-34)30-13-5-3-6-14-30)40-21-12-22-42-44(40)36-29-33(25-28-41(36)47-42)31-15-7-4-8-16-31/h5-29H,1-4H3;3-27H,1-2H3;3-27H,1-2H3;3-29H,1-2H3
InChIKeySYFPDVVXLGOHEV-UHFFFAOYSA-N
XLogP52.25
TPSA65.52 Ų
H-Bond Donors
H-Bond Acceptors9
Rotatable Bonds16
Heavy Atoms192
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002483.16
LogP ≤ 552.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 109

Computed Properties (RDKit)

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

Analyze N-(4-dibenzothiophen-4-ylphenyl)-N-(9,9-dimethylfluoren-4-yl)dibenzofuran-1-amine;N-(9,9-dimethylfluoren-4-yl)-N-[2-(9,9-dimethylfluoren-2-yl)phenyl]dibenzofuran-1-amine;N-(9,9-dimethylfluoren-4-yl)-8-phenyl-N-(4-phenylphenyl)dibenzofuran-1-amine;N-(9,9-dimethylfluoren-4-yl)-N-triphenylen-2-yldibenzofuran-1-amine with MolForge

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Related Compounds

N-(9,9-dimethylfluoren-4-yl)-N-(9,9-dimethyl-7-phenylfluoren-2-yl)dibenzofuran-1-amine
CID 138484780
N,N-bis(4-dibenzofuran-4-ylphenyl)spiro[fluorene-9,14'-tetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8,10,12,15,17-nonaene]-4-amine;N-(4-dibenzofuran-4-ylphenyl)-N-(9,9-dimethylfluoren-2-yl)spiro[fluorene-9,14'-tetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8,10,12,15,17-nonaene]-4-amine;N-(4-dibenzofuran-4-ylphenyl)-N-(4-phenylphenyl)spiro[fluorene-9,14'-tetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8,10,12,15,17-nonaene]-4-amine;N-(4-dibenzothiophen-4-ylphenyl)-N-(4-phenylphenyl)spiro[fluorene-9,14'-tetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8,10,12,15,17-nonaene]-4-amine;N-(9,9-dimethylfluoren-2-yl)-8-phenyl-N-spiro[fluorene-9,14'-tetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8,10,12,15,17-nonaene]-4-yldibenzothiophen-2-amine;N-(9,9-dimethylfluoren-2-yl)-N-spiro[fluorene-9,14'-tetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8,10,12,15,17-nonaene]-4-yldibenzofuran-2-amine;N-(4-phenylphenyl)-N-spiro[fluorene-9,14'-tetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8,10,12,15,17-nonaene]-4-yldibenzofuran-4-amine;N-(4-phenylphenyl)-N-spiro[fluorene-9,14'-tetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8,10,12,15,17-nonaene]-4-yldibenzothiophen-4-amine
CID 158897463
N-(4-dibenzothiophen-4-ylphenyl)-N-[4-(9,9-dimethylspiro[anthracene-10,9'-fluorene]-2'-yl)phenyl]dibenzofuran-1-amine
CID 146247420
N-dibenzothiophen-4-yl-N-[2-(4-phenylphenyl)phenyl]dibenzofuran-1-amine;N-dibenzothiophen-4-yl-N-[3-(4-phenylphenyl)phenyl]dibenzofuran-1-amine;N-dibenzothiophen-4-yl-N-[4-(4-phenylphenyl)phenyl]dibenzofuran-1-amine;N-dibenzothiophen-4-yl-N-(4-triphenylen-2-ylphenyl)dibenzofuran-1-amine
CID 163806431
N-(4-dibenzofuran-1-ylphenyl)-N-(3-phenanthren-2-ylphenyl)phenanthren-9-amine;N-(4-dibenzofuran-4-ylphenyl)-N-(4-phenanthren-2-ylphenyl)phenanthren-9-amine;N-(9,9-dimethylfluoren-2-yl)-N-(4-phenanthren-2-ylphenyl)phenanthren-9-amine;N-(9,9-dimethylfluoren-4-yl)-N-(4-phenanthren-2-ylphenyl)phenanthren-9-amine;N-phenanthren-9-yl-N-(3-phenanthren-2-ylphenyl)dibenzofuran-1-amine;N-phenanthren-9-yl-N-(4-phenanthren-2-ylphenyl)dibenzofuran-4-amine;N-phenanthren-9-yl-N-(4-phenanthren-2-ylphenyl)dibenzothiophen-4-amine;N-phenanthren-9-yl-N-(4-phenanthren-2-ylphenyl)triphenylen-2-amine
CID 163965007
7-[3-[4-(4-dibenzothiophen-4-yl-N-[4-(2-phenyldibenzothiophen-3-yl)phenyl]anilino)phenyl]phenyl]-N-(9,9-dimethylfluoren-2-yl)-N-[4-[4-(4-phenylphenyl)dibenzofuran-3-yl]phenyl]triphenylen-2-amine
CID 135277639
N-(4-dibenzothiophen-4-ylphenyl)-N,12-bis(9,9-dimethylfluoren-2-yl)-10,20-dioxapentacyclo[11.7.0.03,11.04,9.014,19]icosa-1(13),2,4,6,8,11,14,16,18-nonaen-5-amine
CID 163666528
4-dibenzothiophen-4-yl-N-(9,9-dimethylfluoren-2-yl)-N-(2-phenylphenyl)-9,14-dioxapentacyclo[11.7.0.02,10.03,8.015,20]icosa-1(13),2(10),3,5,7,11,15,17,19-nonaen-7-amine
CID 170536070
N-(4-dibenzothiophen-4-ylphenyl)-N-(2,5-diphenylphenyl)dibenzofuran-1-amine
CID 155186941
N-[4-[4-(4-dibenzofuran-3-ylphenyl)phenyl]phenyl]-9,9-dimethyl-N,7-diphenylfluoren-2-amine;N-[4-(4-dibenzothiophen-4-ylphenyl)phenyl]-9,9-dimethyl-N-naphthalen-1-yl-7-phenylfluoren-2-amine;N-[4-(4-dibenzothiophen-4-ylphenyl)phenyl]-9,9-dimethyl-7-phenyl-N-(4-phenylphenyl)fluoren-2-amine
CID 159250991
N-[4-(4-dibenzofuran-4-ylphenyl)phenyl]-N-(9,9-dimethylfluoren-2-yl)dibenzothiophen-4-amine;N-[4-(4-dibenzofuran-4-ylphenyl)phenyl]-N-phenyldibenzofuran-4-amine;N-[4-(4-dibenzofuran-4-ylphenyl)phenyl]-N-(4-phenylphenyl)dibenzofuran-4-amine;N-[4-(4-dibenzothiophen-4-ylphenyl)phenyl]-N-(4-phenylphenyl)dibenzofuran-2-amine
CID 160559778
N-[4-(9,9-dimethylfluoren-2-yl)phenyl]-N-[3-phenyl-2-(2-phenylphenyl)phenyl]dibenzofuran-1-amine
CID 168788461

Frequently Asked Questions

What is the IUPAC name of N-(4-dibenzothiophen-4-ylphenyl)-N-(9,9-dimethylfluoren-4-yl)dibenzofuran-1-amine;N-(9,9-dimethylfluoren-4-yl)-N-[2-(9,9-dimethylfluoren-2-yl)phenyl]dibenzofuran-1-amine;N-(9,9-dimethylfluoren-4-yl)-8-phenyl-N-(4-phenylphenyl)dibenzofuran-1-amine;N-(9,9-dimethylfluoren-4-yl)-N-triphenylen-2-yldibenzofuran-1-amine?
The IUPAC name of N-(4-dibenzothiophen-4-ylphenyl)-N-(9,9-dimethylfluoren-4-yl)dibenzofuran-1-amine;N-(9,9-dimethylfluoren-4-yl)-N-[2-(9,9-dimethylfluoren-2-yl)phenyl]dibenzofuran-1-amine;N-(9,9-dimethylfluoren-4-yl)-8-phenyl-N-(4-phenylphenyl)dibenzofuran-1-amine;N-(9,9-dimethylfluoren-4-yl)-N-triphenylen-2-yldibenzofuran-1-amine (CID 160970830) is N-(4-dibenzothiophen-4-ylphenyl)-N-(9,9-dimethylfluoren-4-yl)dibenzofuran-1-amine;N-(9,9-dimethylfluoren-4-yl)-N-[2-(9,9-dimethylfluoren-2-yl)phenyl]dibenzofuran-1-amine;N-(9,9-dimethylfluoren-4-yl)-8-phenyl-N-(4-phenylphenyl)dibenzofuran-1-amine;N-(9,9-dimethylfluoren-4-yl)-N-triphenylen-2-yldibenzofuran-1-amine.
What is the SMILES notation for N-(4-dibenzothiophen-4-ylphenyl)-N-(9,9-dimethylfluoren-4-yl)dibenzofuran-1-amine;N-(9,9-dimethylfluoren-4-yl)-N-[2-(9,9-dimethylfluoren-2-yl)phenyl]dibenzofuran-1-amine;N-(9,9-dimethylfluoren-4-yl)-8-phenyl-N-(4-phenylphenyl)dibenzofuran-1-amine;N-(9,9-dimethylfluoren-4-yl)-N-triphenylen-2-yldibenzofuran-1-amine?
The canonical SMILES for N-(4-dibenzothiophen-4-ylphenyl)-N-(9,9-dimethylfluoren-4-yl)dibenzofuran-1-amine;N-(9,9-dimethylfluoren-4-yl)-N-[2-(9,9-dimethylfluoren-2-yl)phenyl]dibenzofuran-1-amine;N-(9,9-dimethylfluoren-4-yl)-8-phenyl-N-(4-phenylphenyl)dibenzofuran-1-amine;N-(9,9-dimethylfluoren-4-yl)-N-triphenylen-2-yldibenzofuran-1-amine is CC1(C)c2ccccc2-c2c(N(c3ccc(-c4cccc5c4sc4ccccc45)cc3)c3cccc4oc5ccccc5c34)cccc21.CC1(C)c2ccccc2-c2c(N(c3ccc(-c4ccccc4)cc3)c3cccc4oc5ccc(-c6ccccc6)cc5c34)cccc21.CC1(C)c2ccccc2-c2c(N(c3ccc4c5ccccc5c5ccccc5c4c3)c3cccc4oc5ccccc5c34)cccc21.CC1(C)c2ccccc2-c2ccc(-c3ccccc3N(c3cccc4c3-c3ccccc3C4(C)C)c3cccc4oc5ccccc5c34)cc21.
What is the InChIKey of N-(4-dibenzothiophen-4-ylphenyl)-N-(9,9-dimethylfluoren-4-yl)dibenzofuran-1-amine;N-(9,9-dimethylfluoren-4-yl)-N-[2-(9,9-dimethylfluoren-2-yl)phenyl]dibenzofuran-1-amine;N-(9,9-dimethylfluoren-4-yl)-8-phenyl-N-(4-phenylphenyl)dibenzofuran-1-amine;N-(9,9-dimethylfluoren-4-yl)-N-triphenylen-2-yldibenzofuran-1-amine?
The InChIKey is SYFPDVVXLGOHEV-UHFFFAOYSA-N. The full InChI is InChI=1S/C48H37NO.C45H31NOS.C45H31NO.C45H33NO/c1-47(2)37-20-10-6-17-34(37)45-38(47)21-13-23-41(45)49(42-24-14-26-44-46(42)35-18-8-12-25-43(35)50-44)40-22-11-7-15-31(40)30-27-28-33-32-16-5-9-19-36(32)48(3,4)39(33)29-30;1-45(2)35-17-6-3-13-33(35)42-36(45)18-10-19-37(42)46(38-20-11-22-40-43(38)34-14-4-7-21-39(34)47-40)29-26-24-28(25-27-29)30-15-9-16-32-31-12-5-8-23-41(31)48-44(30)32;1-45(2)37-19-9-7-17-34(37)43-38(45)20-11-21-39(43)46(40-22-12-24-42-44(40)35-18-8-10-23-41(35)47-42)28-25-26-33-31-15-4-3-13-29(31)30-14-5-6-16-32(30)36(33)27-28;1-45(2)37-18-10-9-17-35(37)43-38(45)19-11-20-39(43)46(34-26-23-32(24-27-34)30-13-5-3-6-14-30)40-21-12-22-42-44(40)36-29-33(25-28-41(36)47-42)31-15-7-4-8-16-31/h5-29H,1-4H3;3-27H,1-2H3;3-27H,1-2H3;3-29H,1-2H3.
What are the key properties of N-(4-dibenzothiophen-4-ylphenyl)-N-(9,9-dimethylfluoren-4-yl)dibenzofuran-1-amine;N-(9,9-dimethylfluoren-4-yl)-N-[2-(9,9-dimethylfluoren-2-yl)phenyl]dibenzofuran-1-amine;N-(9,9-dimethylfluoren-4-yl)-8-phenyl-N-(4-phenylphenyl)dibenzofuran-1-amine;N-(9,9-dimethylfluoren-4-yl)-N-triphenylen-2-yldibenzofuran-1-amine?
N-(4-dibenzothiophen-4-ylphenyl)-N-(9,9-dimethylfluoren-4-yl)dibenzofuran-1-amine;N-(9,9-dimethylfluoren-4-yl)-N-[2-(9,9-dimethylfluoren-2-yl)phenyl]dibenzofuran-1-amine;N-(9,9-dimethylfluoren-4-yl)-8-phenyl-N-(4-phenylphenyl)dibenzofuran-1-amine;N-(9,9-dimethylfluoren-4-yl)-N-triphenylen-2-yldibenzofuran-1-amine has a molecular weight of 2483.16 g/mol, XLogP of 52.25, 16 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-dibenzothiophen-4-ylphenyl)-N-(9,9-dimethylfluoren-4-yl)dibenzofuran-1-amine;N-(9,9-dimethylfluoren-4-yl)-N-[2-(9,9-dimethylfluoren-2-yl)phenyl]dibenzofuran-1-amine;N-(9,9-dimethylfluoren-4-yl)-8-phenyl-N-(4-phenylphenyl)dibenzofuran-1-amine;N-(9,9-dimethylfluoren-4-yl)-N-triphenylen-2-yldibenzofuran-1-amine is sourced from PubChem (CID 160970830), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).