N-[4-(1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2,4,6,8,10,12(19),13,15,17-nonaen-10-yl)phenyl]-4-phenyl-N-(4-phenylphenyl)aniline;N-[4-(1-benzofuran-2-yl)phenyl]-9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]fluoren-2-amine;N,N-bis[4-(9,9-dimethylfluoren-2-yl)phenyl]-2-phenylaniline;N-[4-(7,7-dimethylfluoreno[4,3-b][1]benzofuran-1-yl)phenyl]-4-phenyl-N-(4-phenylphenyl)aniline;9,9-dimethyl-N-(4-phenylphenyl)-N-(4-triphenylen-2-ylphenyl)fluoren-2-amine;N-(9,9-diphenylfluoren-2-yl)-9,9-dimethyl-N-[4-(4-phenylphenyl)phenyl]fluoren-2-amine

C315H230N8O2 — CID 157054318

About N-[4-(1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2,4,6,8,10,12(19),13,15,17-nonaen-10-yl)phenyl]-4-phenyl-N-(4-phenylphenyl)aniline;N-[4-(1-benzofuran-2-yl)phenyl]-9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]fluoren-2-amine;N,N-bis[4-(9,9-dimethylfluoren-2-yl)phenyl]-2-phenylaniline;N-[4-(7,7-dimethylfluoreno[4,3-b][1]benzofuran-1-yl)phenyl]-4-phenyl-N-(4-phenylphenyl)aniline;9,9-dimethyl-N-(4-phenylphenyl)-N-(4-triphenylen-2-ylphenyl)fluoren-2-amine;N-(9,9-diphenylfluoren-2-yl)-9,9-dimethyl-N-[4-(4-phenylphenyl)phenyl]fluoren-2-amine

N-[4-(1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2,4,6,8,10,12(19),13,15,17-nonaen-10-yl)phenyl]-4-phenyl-N-(4-phenylphenyl)aniline;N-[4-(1-benzofuran-2-yl)phenyl]-9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]fluoren-2-amine;N,N-bis[4-(9,9-dimethylfluoren-2-yl)phenyl]-2-phenylaniline;N-[4-(7,7-dimethylfluoreno[4,3-b][1]benzofuran-1-yl)phenyl]-4-phenyl-N-(4-phenylphenyl)aniline;9,9-dimethyl-N-(4-phenylphenyl)-N-(4-triphenylen-2-ylphenyl)fluoren-2-amine;N-(9,9-diphenylfluoren-2-yl)-9,9-dimethyl-N-[4-(4-phenylphenyl)phenyl]fluoren-2-amine (PubChem CID 157054318) has the molecular formula C315H230N8O2 and a molecular weight of 4159.36 g/mol. Its IUPAC name is N-[4-(1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2,4,6,8,10,12(19),13,15,17-nonaen-10-yl)phenyl]-4-phenyl-N-(4-phenylphenyl)aniline;N-[4-(1-benzofuran-2-yl)phenyl]-9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]fluoren-2-amine;N,N-bis[4-(9,9-dimethylfluoren-2-yl)phenyl]-2-phenylaniline;N-[4-(7,7-dimethylfluoreno[4,3-b][1]benzofuran-1-yl)phenyl]-4-phenyl-N-(4-phenylphenyl)aniline;9,9-dimethyl-N-(4-phenylphenyl)-N-(4-triphenylen-2-ylphenyl)fluoren-2-amine;N-(9,9-diphenylfluoren-2-yl)-9,9-dimethyl-N-[4-(4-phenylphenyl)phenyl]fluoren-2-amine.

Molecular Properties

• Compound Name: N-[4-(1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2,4,6,8,10,12(19),13,15,17-nonaen-10-yl)phenyl]-4-phenyl-N-(4-phenylphenyl)aniline;N-[4-(1-benzofuran-2-yl)phenyl]-9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]fluoren-2-amine;N,N-bis[4-(9,9-dimethylfluoren-2-yl)phenyl]-2-phenylaniline;N-[4-(7,7-dimethylfluoreno[4,3-b][1]benzofuran-1-yl)phenyl]-4-phenyl-N-(4-phenylphenyl)aniline;9,9-dimethyl-N-(4-phenylphenyl)-N-(4-triphenylen-2-ylphenyl)fluoren-2-amine;N-(9,9-diphenylfluoren-2-yl)-9,9-dimethyl-N-[4-(4-phenylphenyl)phenyl]fluoren-2-amine
• PubChem CID: 157054318
• Molecular Formula: C315H230N8O2
• Molecular Weight: 4159.36 g/mol
• Exact Mass: 4155.81
• IUPAC Name: N-[4-(1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2,4,6,8,10,12(19),13,15,17-nonaen-10-yl)phenyl]-4-phenyl-N-(4-phenylphenyl)aniline;N-[4-(1-benzofuran-2-yl)phenyl]-9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]fluoren-2-amine;N,N-bis[4-(9,9-dimethylfluoren-2-yl)phenyl]-2-phenylaniline;N-[4-(7,7-dimethylfluoreno[4,3-b][1]benzofuran-1-yl)phenyl]-4-phenyl-N-(4-phenylphenyl)aniline;9,9-dimethyl-N-(4-phenylphenyl)-N-(4-triphenylen-2-ylphenyl)fluoren-2-amine;N-(9,9-diphenylfluoren-2-yl)-9,9-dimethyl-N-[4-(4-phenylphenyl)phenyl]fluoren-2-amine
• SMILES: CC1(C)c2ccccc2-c2c1ccc1c2oc2c(-c3ccc(N(c4ccc(-c5ccccc5)cc4)c4ccc(-c5ccccc5)cc4)cc3)cccc21.CC1(C)c2ccccc2-c2ccc(-c3ccc(N(c4ccc(-c5ccc6c(c5)C(C)(C)c5ccccc5-6)cc4)c4ccccc4-c4ccccc4)cc3)cc21.CC1(C)c2ccccc2-c2ccc(N(c3ccc(-c4ccc(-c5ccccc5)cc4)cc3)c3ccc4c(c3)C(c3ccccc3)(c3ccccc3)c3ccccc3-4)cc21.CC1(C)c2ccccc2-c2ccc(N(c3ccc(-c4ccc5c(c4)c4ccccc4n5-c4ccccc4)cc3)c3ccc(-c4cc5ccccc5o4)cc3)cc21.CC1(C)c2ccccc2-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc(-c4ccc5c6ccccc6c6ccccc6c5c4)cc3)cc21.c1ccc(-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc(-c4cc5c6ccccc6n6c7ccccc7c(c4)c56)cc3)cc2)cc1
• InChI: InChI=1S/C58H43N.C54H43N.C53H38N2O.C51H37NO.C51H37N.C48H32N2/c1-57(2)53-24-14-12-22-49(53)51-36-34-47(38-55(51)57)59(46-32-30-43(31-33-46)42-28-26-41(27-29-42)40-16-6-3-7-17-40)48-35-37-52-50-23-13-15-25-54(50)58(56(52)39-48,44-18-8-4-9-19-44)45-20-10-5-11-21-45;1-53(2)48-19-11-8-17-44(48)46-32-26-39(34-50(46)53)36-22-28-41(29-23-36)55(52-21-13-10-16-43(52)38-14-6-5-7-15-38)42-30-24-37(25-31-42)40-27-33-47-45-18-9-12-20-49(45)54(3,4)51(47)35-40;1-53(2)47-17-9-7-15-43(47)44-30-29-42(34-48(44)53)54(41-27-22-36(23-28-41)52-33-38-12-6-11-19-51(38)56-52)40-25-20-35(21-26-40)37-24-31-50-46(32-37)45-16-8-10-18-49(45)55(50)39-13-4-3-5-14-39;1-51(2)46-19-10-9-16-45(46)48-47(51)33-32-44-43-18-11-17-42(49(43)53-50(44)48)38-24-30-41(31-25-38)52(39-26-20-36(21-27-39)34-12-5-3-6-13-34)40-28-22-37(23-29-40)35-14-7-4-8-15-35;1-51(2)49-19-11-10-18-46(49)47-31-29-40(33-50(47)51)52(38-25-20-35(21-26-38)34-12-4-3-5-13-34)39-27-22-36(23-28-39)37-24-30-45-43-16-7-6-14-41(43)42-15-8-9-17-44(42)48(45)32-37;1-3-11-33(12-4-1)35-19-25-39(26-20-35)49(40-27-21-36(22-28-40)34-13-5-2-6-14-34)41-29-23-37(24-30-41)38-31-44-42-15-7-9-17-46(42)50-47-18-10-8-16-43(47)45(32-38)48(44)50/h3-39H,1-2H3;5-35H,1-4H3;3-34H,1-2H3;3-33H,1-2H3;3-33H,1-2H3;1-32H
• InChIKey: AAOMAUGEOIOTKU-UHFFFAOYSA-N
• XLogP: 86.50
• TPSA: 55.06 Ų
• H-Bond Acceptors: 10
• Rotatable Bonds: 36
• Heavy Atoms: 325
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	4159.36
LogP ≤ 5	86.50
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	10

Frequently Asked Questions

What is the IUPAC name of N-[4-(1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2,4,6,8,10,12(19),13,15,17-nonaen-10-yl)phenyl]-4-phenyl-N-(4-phenylphenyl)aniline;N-[4-(1-benzofuran-2-yl)phenyl]-9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]fluoren-2-amine;N,N-bis[4-(9,9-dimethylfluoren-2-yl)phenyl]-2-phenylaniline;N-[4-(7,7-dimethylfluoreno[4,3-b][1]benzofuran-1-yl)phenyl]-4-phenyl-N-(4-phenylphenyl)aniline;9,9-dimethyl-N-(4-phenylphenyl)-N-(4-triphenylen-2-ylphenyl)fluoren-2-amine;N-(9,9-diphenylfluoren-2-yl)-9,9-dimethyl-N-[4-(4-phenylphenyl)phenyl]fluoren-2-amine?

The IUPAC name of N-[4-(1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2,4,6,8,10,12(19),13,15,17-nonaen-10-yl)phenyl]-4-phenyl-N-(4-phenylphenyl)aniline;N-[4-(1-benzofuran-2-yl)phenyl]-9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]fluoren-2-amine;N,N-bis[4-(9,9-dimethylfluoren-2-yl)phenyl]-2-phenylaniline;N-[4-(7,7-dimethylfluoreno[4,3-b][1]benzofuran-1-yl)phenyl]-4-phenyl-N-(4-phenylphenyl)aniline;9,9-dimethyl-N-(4-phenylphenyl)-N-(4-triphenylen-2-ylphenyl)fluoren-2-amine;N-(9,9-diphenylfluoren-2-yl)-9,9-dimethyl-N-[4-(4-phenylphenyl)phenyl]fluoren-2-amine (CID 157054318) is N-[4-(1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2,4,6,8,10,12(19),13,15,17-nonaen-10-yl)phenyl]-4-phenyl-N-(4-phenylphenyl)aniline;N-[4-(1-benzofuran-2-yl)phenyl]-9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]fluoren-2-amine;N,N-bis[4-(9,9-dimethylfluoren-2-yl)phenyl]-2-phenylaniline;N-[4-(7,7-dimethylfluoreno[4,3-b][1]benzofuran-1-yl)phenyl]-4-phenyl-N-(4-phenylphenyl)aniline;9,9-dimethyl-N-(4-phenylphenyl)-N-(4-triphenylen-2-ylphenyl)fluoren-2-amine;N-(9,9-diphenylfluoren-2-yl)-9,9-dimethyl-N-[4-(4-phenylphenyl)phenyl]fluoren-2-amine.

What is the SMILES notation for N-[4-(1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2,4,6,8,10,12(19),13,15,17-nonaen-10-yl)phenyl]-4-phenyl-N-(4-phenylphenyl)aniline;N-[4-(1-benzofuran-2-yl)phenyl]-9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]fluoren-2-amine;N,N-bis[4-(9,9-dimethylfluoren-2-yl)phenyl]-2-phenylaniline;N-[4-(7,7-dimethylfluoreno[4,3-b][1]benzofuran-1-yl)phenyl]-4-phenyl-N-(4-phenylphenyl)aniline;9,9-dimethyl-N-(4-phenylphenyl)-N-(4-triphenylen-2-ylphenyl)fluoren-2-amine;N-(9,9-diphenylfluoren-2-yl)-9,9-dimethyl-N-[4-(4-phenylphenyl)phenyl]fluoren-2-amine?

The canonical SMILES for N-[4-(1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2,4,6,8,10,12(19),13,15,17-nonaen-10-yl)phenyl]-4-phenyl-N-(4-phenylphenyl)aniline;N-[4-(1-benzofuran-2-yl)phenyl]-9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]fluoren-2-amine;N,N-bis[4-(9,9-dimethylfluoren-2-yl)phenyl]-2-phenylaniline;N-[4-(7,7-dimethylfluoreno[4,3-b][1]benzofuran-1-yl)phenyl]-4-phenyl-N-(4-phenylphenyl)aniline;9,9-dimethyl-N-(4-phenylphenyl)-N-(4-triphenylen-2-ylphenyl)fluoren-2-amine;N-(9,9-diphenylfluoren-2-yl)-9,9-dimethyl-N-[4-(4-phenylphenyl)phenyl]fluoren-2-amine is CC1(C)c2ccccc2-c2c1ccc1c2oc2c(-c3ccc(N(c4ccc(-c5ccccc5)cc4)c4ccc(-c5ccccc5)cc4)cc3)cccc21.CC1(C)c2ccccc2-c2ccc(-c3ccc(N(c4ccc(-c5ccc6c(c5)C(C)(C)c5ccccc5-6)cc4)c4ccccc4-c4ccccc4)cc3)cc21.CC1(C)c2ccccc2-c2ccc(N(c3ccc(-c4ccc(-c5ccccc5)cc4)cc3)c3ccc4c(c3)C(c3ccccc3)(c3ccccc3)c3ccccc3-4)cc21.CC1(C)c2ccccc2-c2ccc(N(c3ccc(-c4ccc5c(c4)c4ccccc4n5-c4ccccc4)cc3)c3ccc(-c4cc5ccccc5o4)cc3)cc21.CC1(C)c2ccccc2-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc(-c4ccc5c6ccccc6c6ccccc6c5c4)cc3)cc21.c1ccc(-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc(-c4cc5c6ccccc6n6c7ccccc7c(c4)c56)cc3)cc2)cc1.

What is the InChIKey of N-[4-(1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2,4,6,8,10,12(19),13,15,17-nonaen-10-yl)phenyl]-4-phenyl-N-(4-phenylphenyl)aniline;N-[4-(1-benzofuran-2-yl)phenyl]-9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]fluoren-2-amine;N,N-bis[4-(9,9-dimethylfluoren-2-yl)phenyl]-2-phenylaniline;N-[4-(7,7-dimethylfluoreno[4,3-b][1]benzofuran-1-yl)phenyl]-4-phenyl-N-(4-phenylphenyl)aniline;9,9-dimethyl-N-(4-phenylphenyl)-N-(4-triphenylen-2-ylphenyl)fluoren-2-amine;N-(9,9-diphenylfluoren-2-yl)-9,9-dimethyl-N-[4-(4-phenylphenyl)phenyl]fluoren-2-amine?

The InChIKey is AAOMAUGEOIOTKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C58H43N.C54H43N.C53H38N2O.C51H37NO.C51H37N.C48H32N2/c1-57(2)53-24-14-12-22-49(53)51-36-34-47(38-55(51)57)59(46-32-30-43(31-33-46)42-28-26-41(27-29-42)40-16-6-3-7-17-40)48-35-37-52-50-23-13-15-25-54(50)58(56(52)39-48,44-18-8-4-9-19-44)45-20-10-5-11-21-45;1-53(2)48-19-11-8-17-44(48)46-32-26-39(34-50(46)53)36-22-28-41(29-23-36)55(52-21-13-10-16-43(52)38-14-6-5-7-15-38)42-30-24-37(25-31-42)40-27-33-47-45-18-9-12-20-49(45)54(3,4)51(47)35-40;1-53(2)47-17-9-7-15-43(47)44-30-29-42(34-48(44)53)54(41-27-22-36(23-28-41)52-33-38-12-6-11-19-51(38)56-52)40-25-20-35(21-26-40)37-24-31-50-46(32-37)45-16-8-10-18-49(45)55(50)39-13-4-3-5-14-39;1-51(2)46-19-10-9-16-45(46)48-47(51)33-32-44-43-18-11-17-42(49(43)53-50(44)48)38-24-30-41(31-25-38)52(39-26-20-36(21-27-39)34-12-5-3-6-13-34)40-28-22-37(23-29-40)35-14-7-4-8-15-35;1-51(2)49-19-11-10-18-46(49)47-31-29-40(33-50(47)51)52(38-25-20-35(21-26-38)34-12-4-3-5-13-34)39-27-22-36(23-28-39)37-24-30-45-43-16-7-6-14-41(43)42-15-8-9-17-44(42)48(45)32-37;1-3-11-33(12-4-1)35-19-25-39(26-20-35)49(40-27-21-36(22-28-40)34-13-5-2-6-14-34)41-29-23-37(24-30-41)38-31-44-42-15-7-9-17-46(42)50-47-18-10-8-16-43(47)45(32-38)48(44)50/h3-39H,1-2H3;5-35H,1-4H3;3-34H,1-2H3;3-33H,1-2H3;3-33H,1-2H3;1-32H.

What are the key properties of N-[4-(1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2,4,6,8,10,12(19),13,15,17-nonaen-10-yl)phenyl]-4-phenyl-N-(4-phenylphenyl)aniline;N-[4-(1-benzofuran-2-yl)phenyl]-9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]fluoren-2-amine;N,N-bis[4-(9,9-dimethylfluoren-2-yl)phenyl]-2-phenylaniline;N-[4-(7,7-dimethylfluoreno[4,3-b][1]benzofuran-1-yl)phenyl]-4-phenyl-N-(4-phenylphenyl)aniline;9,9-dimethyl-N-(4-phenylphenyl)-N-(4-triphenylen-2-ylphenyl)fluoren-2-amine;N-(9,9-diphenylfluoren-2-yl)-9,9-dimethyl-N-[4-(4-phenylphenyl)phenyl]fluoren-2-amine?

N-[4-(1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2,4,6,8,10,12(19),13,15,17-nonaen-10-yl)phenyl]-4-phenyl-N-(4-phenylphenyl)aniline;N-[4-(1-benzofuran-2-yl)phenyl]-9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]fluoren-2-amine;N,N-bis[4-(9,9-dimethylfluoren-2-yl)phenyl]-2-phenylaniline;N-[4-(7,7-dimethylfluoreno[4,3-b][1]benzofuran-1-yl)phenyl]-4-phenyl-N-(4-phenylphenyl)aniline;9,9-dimethyl-N-(4-phenylphenyl)-N-(4-triphenylen-2-ylphenyl)fluoren-2-amine;N-(9,9-diphenylfluoren-2-yl)-9,9-dimethyl-N-[4-(4-phenylphenyl)phenyl]fluoren-2-amine has a molecular weight of 4159.36 g/mol, XLogP of 86.50, 36 rotatable bonds, 0 hydrogen bond donors, and 10 hydrogen bond acceptors.

Where does this data come from?

All data for N-[4-(1-azapentacyclo[10.6.1.02,7.08,19.013,18]nonadeca-2,4,6,8,10,12(19),13,15,17-nonaen-10-yl)phenyl]-4-phenyl-N-(4-phenylphenyl)aniline;N-[4-(1-benzofuran-2-yl)phenyl]-9,9-dimethyl-N-[4-(9-phenylcarbazol-3-yl)phenyl]fluoren-2-amine;N,N-bis[4-(9,9-dimethylfluoren-2-yl)phenyl]-2-phenylaniline;N-[4-(7,7-dimethylfluoreno[4,3-b][1]benzofuran-1-yl)phenyl]-4-phenyl-N-(4-phenylphenyl)aniline;9,9-dimethyl-N-(4-phenylphenyl)-N-(4-triphenylen-2-ylphenyl)fluoren-2-amine;N-(9,9-diphenylfluoren-2-yl)-9,9-dimethyl-N-[4-(4-phenylphenyl)phenyl]fluoren-2-amine is sourced from PubChem (CID 157054318), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).