N-(4-dibenzofuran-4-ylphenyl)-11,11-dimethyl-N-(4-phenylphenyl)benzo[a]fluoren-7-amine;N-(9,9-dimethylfluoren-2-yl)-N-(4-phenylphenyl)-3-oxapentacyclo[11.8.0.02,10.04,9.016,21]henicosa-1(13),2(10),4,6,8,11,14,16(21),17,19-decaen-18-amine;9,9-dimethyl-N-(4-naphtho[2,1-b][1]benzofuran-8-ylphenyl)-N-(4-phenylphenyl)fluoren-2-amine;9-(4-phenylphenyl)-2-[9-(4-phenylphenyl)carbazol-3-yl]carbazole

C193H135N5O3 — CID 163577680

IUPACN-(4-dibenzofuran-4-ylphenyl)-11,11-dimethyl-N-(4-phenylphenyl)benzo[a]fluoren-7-amine;N-(9,9-dimethylfluoren-2-yl)-N-(4-phenylphenyl)-3-oxapentacyclo[11.8.0.02,10.04,9.016,21]henicosa-1(13),2(10),4,6,8,11,14,16(21),17,19-decaen-18-amine;9,9-dimethyl-N-(4-naphtho[2,1-b][1]benzofuran-8-ylphenyl)-N-(4-phenylphenyl)fluoren-2-amine;9-(4-phenylphenyl)-2-[9-(4-phenylphenyl)carbazol-3-yl]carbazole
SMILESCC1(C)c2cccc(N(c3ccc(-c4ccccc4)cc3)c3ccc(-c4cccc5c4oc4ccccc45)cc3)c2-c2ccc3ccccc3c21.CC1(C)c2ccccc2-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc(-c4cccc5c4oc4ccc6ccccc6c45)cc3)cc21.CC1(C)c2ccccc2-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc4c(ccc5ccc6c7ccccc7oc6c54)c3)cc21.c1ccc(-c2ccc(-n3c4ccccc4c4cc(-c5ccc6c7ccccc7n(-c7ccc(-c8ccccc8)cc7)c6c5)ccc43)cc2)cc1
InChIInChI=1S/2C49H35NO.C48H32N2.C47H33NO/c1-49(2)43-19-11-20-44(46(43)42-31-26-34-14-6-7-15-38(34)47(42)49)50(36-27-22-33(23-28-36)32-12-4-3-5-13-32)37-29-24-35(25-30-37)39-17-10-18-41-40-16-8-9-21-45(40)51-48(39)41;1-49(2)44-18-9-8-15-41(44)42-29-28-38(31-45(42)49)50(36-24-19-33(20-25-36)32-11-4-3-5-12-32)37-26-21-35(22-27-37)40-16-10-17-43-47-39-14-7-6-13-34(39)23-30-46(47)51-48(40)43;1-3-11-33(12-4-1)35-19-25-39(26-20-35)49-46-18-10-8-16-42(46)44-31-37(24-30-47(44)49)38-23-29-43-41-15-7-9-17-45(41)50(48(43)32-38)40-27-21-36(22-28-40)34-13-5-2-6-14-34;1-47(2)42-14-8-6-12-38(42)39-27-24-36(29-43(39)47)48(34-21-18-31(19-22-34)30-10-4-3-5-11-30)35-23-26-37-33(28-35)17-16-32-20-25-41-40-13-7-9-15-44(40)49-46(41)45(32)37/h2*3-31H,1-2H3;1-32H;3-29H,1-2H3
InChIKeyGEWYYQKJRCBPAR-UHFFFAOYSA-N
MW2572.23 g/mol
LogP53.92
Rot. Bonds19

About N-(4-dibenzofuran-4-ylphenyl)-11,11-dimethyl-N-(4-phenylphenyl)benzo[a]fluoren-7-amine;N-(9,9-dimethylfluoren-2-yl)-N-(4-phenylphenyl)-3-oxapentacyclo[11.8.0.02,10.04,9.016,21]henicosa-1(13),2(10),4,6,8,11,14,16(21),17,19-decaen-18-amine;9,9-dimethyl-N-(4-naphtho[2,1-b][1]benzofuran-8-ylphenyl)-N-(4-phenylphenyl)fluoren-2-amine;9-(4-phenylphenyl)-2-[9-(4-phenylphenyl)carbazol-3-yl]carbazole

N-(4-dibenzofuran-4-ylphenyl)-11,11-dimethyl-N-(4-phenylphenyl)benzo[a]fluoren-7-amine;N-(9,9-dimethylfluoren-2-yl)-N-(4-phenylphenyl)-3-oxapentacyclo[11.8.0.02,10.04,9.016,21]henicosa-1(13),2(10),4,6,8,11,14,16(21),17,19-decaen-18-amine;9,9-dimethyl-N-(4-naphtho[2,1-b][1]benzofuran-8-ylphenyl)-N-(4-phenylphenyl)fluoren-2-amine;9-(4-phenylphenyl)-2-[9-(4-phenylphenyl)carbazol-3-yl]carbazole (PubChem CID 163577680) has the molecular formula C193H135N5O3 and a molecular weight of 2572.23 g/mol. Its IUPAC name is N-(4-dibenzofuran-4-ylphenyl)-11,11-dimethyl-N-(4-phenylphenyl)benzo[a]fluoren-7-amine;N-(9,9-dimethylfluoren-2-yl)-N-(4-phenylphenyl)-3-oxapentacyclo[11.8.0.02,10.04,9.016,21]henicosa-1(13),2(10),4,6,8,11,14,16(21),17,19-decaen-18-amine;9,9-dimethyl-N-(4-naphtho[2,1-b][1]benzofuran-8-ylphenyl)-N-(4-phenylphenyl)fluoren-2-amine;9-(4-phenylphenyl)-2-[9-(4-phenylphenyl)carbazol-3-yl]carbazole.

Molecular Properties

Compound NameN-(4-dibenzofuran-4-ylphenyl)-11,11-dimethyl-N-(4-phenylphenyl)benzo[a]fluoren-7-amine;N-(9,9-dimethylfluoren-2-yl)-N-(4-phenylphenyl)-3-oxapentacyclo[11.8.0.02,10.04,9.016,21]henicosa-1(13),2(10),4,6,8,11,14,16(21),17,19-decaen-18-amine;9,9-dimethyl-N-(4-naphtho[2,1-b][1]benzofuran-8-ylphenyl)-N-(4-phenylphenyl)fluoren-2-amine;9-(4-phenylphenyl)-2-[9-(4-phenylphenyl)carbazol-3-yl]carbazole
PubChem CID163577680
Molecular FormulaC193H135N5O3
Molecular Weight2572.23 g/mol
Exact Mass2570.06
IUPAC NameN-(4-dibenzofuran-4-ylphenyl)-11,11-dimethyl-N-(4-phenylphenyl)benzo[a]fluoren-7-amine;N-(9,9-dimethylfluoren-2-yl)-N-(4-phenylphenyl)-3-oxapentacyclo[11.8.0.02,10.04,9.016,21]henicosa-1(13),2(10),4,6,8,11,14,16(21),17,19-decaen-18-amine;9,9-dimethyl-N-(4-naphtho[2,1-b][1]benzofuran-8-ylphenyl)-N-(4-phenylphenyl)fluoren-2-amine;9-(4-phenylphenyl)-2-[9-(4-phenylphenyl)carbazol-3-yl]carbazole
SMILESCC1(C)c2cccc(N(c3ccc(-c4ccccc4)cc3)c3ccc(-c4cccc5c4oc4ccccc45)cc3)c2-c2ccc3ccccc3c21.CC1(C)c2ccccc2-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc(-c4cccc5c4oc4ccc6ccccc6c45)cc3)cc21.CC1(C)c2ccccc2-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc4c(ccc5ccc6c7ccccc7oc6c54)c3)cc21.c1ccc(-c2ccc(-n3c4ccccc4c4cc(-c5ccc6c7ccccc7n(-c7ccc(-c8ccccc8)cc7)c6c5)ccc43)cc2)cc1
InChIInChI=1S/2C49H35NO.C48H32N2.C47H33NO/c1-49(2)43-19-11-20-44(46(43)42-31-26-34-14-6-7-15-38(34)47(42)49)50(36-27-22-33(23-28-36)32-12-4-3-5-13-32)37-29-24-35(25-30-37)39-17-10-18-41-40-16-8-9-21-45(40)51-48(39)41;1-49(2)44-18-9-8-15-41(44)42-29-28-38(31-45(42)49)50(36-24-19-33(20-25-36)32-11-4-3-5-12-32)37-26-21-35(22-27-37)40-16-10-17-43-47-39-14-7-6-13-34(39)23-30-46(47)51-48(40)43;1-3-11-33(12-4-1)35-19-25-39(26-20-35)49-46-18-10-8-16-42(46)44-31-37(24-30-47(44)49)38-23-29-43-41-15-7-9-17-45(41)50(48(43)32-38)40-27-21-36(22-28-40)34-13-5-2-6-14-34;1-47(2)42-14-8-6-12-38(42)39-27-24-36(29-43(39)47)48(34-21-18-31(19-22-34)30-10-4-3-5-11-30)35-23-26-37-33(28-35)17-16-32-20-25-41-40-13-7-9-15-44(40)49-46(41)45(32)37/h2*3-31H,1-2H3;1-32H;3-29H,1-2H3
InChIKeyGEWYYQKJRCBPAR-UHFFFAOYSA-N
XLogP53.92
TPSA59.00 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds19
Heavy Atoms201
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002572.23
LogP ≤ 553.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

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

Analyze N-(4-dibenzofuran-4-ylphenyl)-11,11-dimethyl-N-(4-phenylphenyl)benzo[a]fluoren-7-amine;N-(9,9-dimethylfluoren-2-yl)-N-(4-phenylphenyl)-3-oxapentacyclo[11.8.0.02,10.04,9.016,21]henicosa-1(13),2(10),4,6,8,11,14,16(21),17,19-decaen-18-amine;9,9-dimethyl-N-(4-naphtho[2,1-b][1]benzofuran-8-ylphenyl)-N-(4-phenylphenyl)fluoren-2-amine;9-(4-phenylphenyl)-2-[9-(4-phenylphenyl)carbazol-3-yl]carbazole with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-(4-dibenzofuran-4-ylphenyl)-11,11-dimethyl-N-(4-phenylphenyl)benzo[a]fluoren-7-amine;N-(9,9-dimethylfluoren-2-yl)-N-(4-phenylphenyl)-3-oxapentacyclo[11.8.0.02,10.04,9.016,21]henicosa-1(13),2(10),4,6,8,11,14,16(21),17,19-decaen-18-amine;9,9-dimethyl-N-(4-naphtho[2,1-b][1]benzofuran-8-ylphenyl)-N-(4-phenylphenyl)fluoren-2-amine;9-(4-phenylphenyl)-2-[9-(4-phenylphenyl)carbazol-3-yl]carbazole?
The IUPAC name of N-(4-dibenzofuran-4-ylphenyl)-11,11-dimethyl-N-(4-phenylphenyl)benzo[a]fluoren-7-amine;N-(9,9-dimethylfluoren-2-yl)-N-(4-phenylphenyl)-3-oxapentacyclo[11.8.0.02,10.04,9.016,21]henicosa-1(13),2(10),4,6,8,11,14,16(21),17,19-decaen-18-amine;9,9-dimethyl-N-(4-naphtho[2,1-b][1]benzofuran-8-ylphenyl)-N-(4-phenylphenyl)fluoren-2-amine;9-(4-phenylphenyl)-2-[9-(4-phenylphenyl)carbazol-3-yl]carbazole (CID 163577680) is N-(4-dibenzofuran-4-ylphenyl)-11,11-dimethyl-N-(4-phenylphenyl)benzo[a]fluoren-7-amine;N-(9,9-dimethylfluoren-2-yl)-N-(4-phenylphenyl)-3-oxapentacyclo[11.8.0.02,10.04,9.016,21]henicosa-1(13),2(10),4,6,8,11,14,16(21),17,19-decaen-18-amine;9,9-dimethyl-N-(4-naphtho[2,1-b][1]benzofuran-8-ylphenyl)-N-(4-phenylphenyl)fluoren-2-amine;9-(4-phenylphenyl)-2-[9-(4-phenylphenyl)carbazol-3-yl]carbazole.
What is the SMILES notation for N-(4-dibenzofuran-4-ylphenyl)-11,11-dimethyl-N-(4-phenylphenyl)benzo[a]fluoren-7-amine;N-(9,9-dimethylfluoren-2-yl)-N-(4-phenylphenyl)-3-oxapentacyclo[11.8.0.02,10.04,9.016,21]henicosa-1(13),2(10),4,6,8,11,14,16(21),17,19-decaen-18-amine;9,9-dimethyl-N-(4-naphtho[2,1-b][1]benzofuran-8-ylphenyl)-N-(4-phenylphenyl)fluoren-2-amine;9-(4-phenylphenyl)-2-[9-(4-phenylphenyl)carbazol-3-yl]carbazole?
The canonical SMILES for N-(4-dibenzofuran-4-ylphenyl)-11,11-dimethyl-N-(4-phenylphenyl)benzo[a]fluoren-7-amine;N-(9,9-dimethylfluoren-2-yl)-N-(4-phenylphenyl)-3-oxapentacyclo[11.8.0.02,10.04,9.016,21]henicosa-1(13),2(10),4,6,8,11,14,16(21),17,19-decaen-18-amine;9,9-dimethyl-N-(4-naphtho[2,1-b][1]benzofuran-8-ylphenyl)-N-(4-phenylphenyl)fluoren-2-amine;9-(4-phenylphenyl)-2-[9-(4-phenylphenyl)carbazol-3-yl]carbazole is CC1(C)c2cccc(N(c3ccc(-c4ccccc4)cc3)c3ccc(-c4cccc5c4oc4ccccc45)cc3)c2-c2ccc3ccccc3c21.CC1(C)c2ccccc2-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc(-c4cccc5c4oc4ccc6ccccc6c45)cc3)cc21.CC1(C)c2ccccc2-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc4c(ccc5ccc6c7ccccc7oc6c54)c3)cc21.c1ccc(-c2ccc(-n3c4ccccc4c4cc(-c5ccc6c7ccccc7n(-c7ccc(-c8ccccc8)cc7)c6c5)ccc43)cc2)cc1.
What is the InChIKey of N-(4-dibenzofuran-4-ylphenyl)-11,11-dimethyl-N-(4-phenylphenyl)benzo[a]fluoren-7-amine;N-(9,9-dimethylfluoren-2-yl)-N-(4-phenylphenyl)-3-oxapentacyclo[11.8.0.02,10.04,9.016,21]henicosa-1(13),2(10),4,6,8,11,14,16(21),17,19-decaen-18-amine;9,9-dimethyl-N-(4-naphtho[2,1-b][1]benzofuran-8-ylphenyl)-N-(4-phenylphenyl)fluoren-2-amine;9-(4-phenylphenyl)-2-[9-(4-phenylphenyl)carbazol-3-yl]carbazole?
The InChIKey is GEWYYQKJRCBPAR-UHFFFAOYSA-N. The full InChI is InChI=1S/2C49H35NO.C48H32N2.C47H33NO/c1-49(2)43-19-11-20-44(46(43)42-31-26-34-14-6-7-15-38(34)47(42)49)50(36-27-22-33(23-28-36)32-12-4-3-5-13-32)37-29-24-35(25-30-37)39-17-10-18-41-40-16-8-9-21-45(40)51-48(39)41;1-49(2)44-18-9-8-15-41(44)42-29-28-38(31-45(42)49)50(36-24-19-33(20-25-36)32-11-4-3-5-12-32)37-26-21-35(22-27-37)40-16-10-17-43-47-39-14-7-6-13-34(39)23-30-46(47)51-48(40)43;1-3-11-33(12-4-1)35-19-25-39(26-20-35)49-46-18-10-8-16-42(46)44-31-37(24-30-47(44)49)38-23-29-43-41-15-7-9-17-45(41)50(48(43)32-38)40-27-21-36(22-28-40)34-13-5-2-6-14-34;1-47(2)42-14-8-6-12-38(42)39-27-24-36(29-43(39)47)48(34-21-18-31(19-22-34)30-10-4-3-5-11-30)35-23-26-37-33(28-35)17-16-32-20-25-41-40-13-7-9-15-44(40)49-46(41)45(32)37/h2*3-31H,1-2H3;1-32H;3-29H,1-2H3.
What are the key properties of N-(4-dibenzofuran-4-ylphenyl)-11,11-dimethyl-N-(4-phenylphenyl)benzo[a]fluoren-7-amine;N-(9,9-dimethylfluoren-2-yl)-N-(4-phenylphenyl)-3-oxapentacyclo[11.8.0.02,10.04,9.016,21]henicosa-1(13),2(10),4,6,8,11,14,16(21),17,19-decaen-18-amine;9,9-dimethyl-N-(4-naphtho[2,1-b][1]benzofuran-8-ylphenyl)-N-(4-phenylphenyl)fluoren-2-amine;9-(4-phenylphenyl)-2-[9-(4-phenylphenyl)carbazol-3-yl]carbazole?
N-(4-dibenzofuran-4-ylphenyl)-11,11-dimethyl-N-(4-phenylphenyl)benzo[a]fluoren-7-amine;N-(9,9-dimethylfluoren-2-yl)-N-(4-phenylphenyl)-3-oxapentacyclo[11.8.0.02,10.04,9.016,21]henicosa-1(13),2(10),4,6,8,11,14,16(21),17,19-decaen-18-amine;9,9-dimethyl-N-(4-naphtho[2,1-b][1]benzofuran-8-ylphenyl)-N-(4-phenylphenyl)fluoren-2-amine;9-(4-phenylphenyl)-2-[9-(4-phenylphenyl)carbazol-3-yl]carbazole has a molecular weight of 2572.23 g/mol, XLogP of 53.92, 19 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-dibenzofuran-4-ylphenyl)-11,11-dimethyl-N-(4-phenylphenyl)benzo[a]fluoren-7-amine;N-(9,9-dimethylfluoren-2-yl)-N-(4-phenylphenyl)-3-oxapentacyclo[11.8.0.02,10.04,9.016,21]henicosa-1(13),2(10),4,6,8,11,14,16(21),17,19-decaen-18-amine;9,9-dimethyl-N-(4-naphtho[2,1-b][1]benzofuran-8-ylphenyl)-N-(4-phenylphenyl)fluoren-2-amine;9-(4-phenylphenyl)-2-[9-(4-phenylphenyl)carbazol-3-yl]carbazole is sourced from PubChem (CID 163577680), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).