N-(4-dibenzothiophen-4-ylphenyl)-N-(4-phenylphenyl)phenanthren-4-amine;N-(9,9-dimethylfluoren-2-yl)-N-[4-(9-phenylcarbazol-3-yl)phenyl]phenanthren-4-amine;N-(2,4-diphenylphenyl)-N-phenylphenanthren-4-amine;N-phenanthren-4-yl-N-phenyl-9,9'-spirobi[fluorene]-2-amine

C180H123N5S — CID 158853787

About N-(4-dibenzothiophen-4-ylphenyl)-N-(4-phenylphenyl)phenanthren-4-amine;N-(9,9-dimethylfluoren-2-yl)-N-[4-(9-phenylcarbazol-3-yl)phenyl]phenanthren-4-amine;N-(2,4-diphenylphenyl)-N-phenylphenanthren-4-amine;N-phenanthren-4-yl-N-phenyl-9,9'-spirobi[fluorene]-2-amine

N-(4-dibenzothiophen-4-ylphenyl)-N-(4-phenylphenyl)phenanthren-4-amine;N-(9,9-dimethylfluoren-2-yl)-N-[4-(9-phenylcarbazol-3-yl)phenyl]phenanthren-4-amine;N-(2,4-diphenylphenyl)-N-phenylphenanthren-4-amine;N-phenanthren-4-yl-N-phenyl-9,9'-spirobi[fluorene]-2-amine (PubChem CID 158853787) has the molecular formula C180H123N5S and a molecular weight of 2388.07 g/mol. Its IUPAC name is N-(4-dibenzothiophen-4-ylphenyl)-N-(4-phenylphenyl)phenanthren-4-amine;N-(9,9-dimethylfluoren-2-yl)-N-[4-(9-phenylcarbazol-3-yl)phenyl]phenanthren-4-amine;N-(2,4-diphenylphenyl)-N-phenylphenanthren-4-amine;N-phenanthren-4-yl-N-phenyl-9,9'-spirobi[fluorene]-2-amine.

Molecular Properties

• Compound Name: N-(4-dibenzothiophen-4-ylphenyl)-N-(4-phenylphenyl)phenanthren-4-amine;N-(9,9-dimethylfluoren-2-yl)-N-[4-(9-phenylcarbazol-3-yl)phenyl]phenanthren-4-amine;N-(2,4-diphenylphenyl)-N-phenylphenanthren-4-amine;N-phenanthren-4-yl-N-phenyl-9,9'-spirobi[fluorene]-2-amine
• PubChem CID: 158853787
• Molecular Formula: C180H123N5S
• Molecular Weight: 2388.07 g/mol
• Exact Mass: 2385.95
• IUPAC Name: N-(4-dibenzothiophen-4-ylphenyl)-N-(4-phenylphenyl)phenanthren-4-amine;N-(9,9-dimethylfluoren-2-yl)-N-[4-(9-phenylcarbazol-3-yl)phenyl]phenanthren-4-amine;N-(2,4-diphenylphenyl)-N-phenylphenanthren-4-amine;N-phenanthren-4-yl-N-phenyl-9,9'-spirobi[fluorene]-2-amine
• SMILES: CC1(C)c2ccccc2-c2ccc(N(c3ccc(-c4ccc5c(c4)c4ccccc4n5-c4ccccc4)cc3)c3cccc4ccc5ccccc5c34)cc21.c1ccc(-c2ccc(N(c3ccc(-c4cccc5c4sc4ccccc45)cc3)c3cccc4ccc5ccccc5c34)cc2)cc1.c1ccc(-c2ccc(N(c3ccccc3)c3cccc4ccc5ccccc5c34)c(-c3ccccc3)c2)cc1.c1ccc(N(c2ccc3c(c2)C2(c4ccccc4-c4ccccc42)c2ccccc2-3)c2cccc3ccc4ccccc4c23)cc1
• InChI: InChI=1S/C53H38N2.C45H29N.C44H29NS.C38H27N/c1-53(2)47-20-10-8-18-43(47)44-31-30-41(34-48(44)53)54(51-22-12-14-37-24-23-36-13-6-7-17-42(36)52(37)51)40-28-25-35(26-29-40)38-27-32-50-46(33-38)45-19-9-11-21-49(45)55(50)39-15-4-3-5-16-39;1-2-15-32(16-3-1)46(43-24-12-14-31-26-25-30-13-4-5-17-34(30)44(31)43)33-27-28-38-37-20-8-11-23-41(37)45(42(38)29-33)39-21-9-6-18-35(39)36-19-7-10-22-40(36)45;1-2-10-30(11-3-1)31-22-26-35(27-23-31)45(41-18-8-13-34-21-20-32-12-4-5-14-37(32)43(34)41)36-28-24-33(25-29-36)38-16-9-17-40-39-15-6-7-19-42(39)46-44(38)40;1-4-13-28(14-5-1)32-25-26-36(35(27-32)29-15-6-2-7-16-29)39(33-19-8-3-9-20-33)37-22-12-18-31-24-23-30-17-10-11-21-34(30)38(31)37/h3-34H,1-2H3;2*1-29H;1-27H
• InChIKey: IZUAHDVPGPHIQT-UHFFFAOYSA-N
• XLogP: 50.30
• TPSA: 17.89 Ų
• H-Bond Acceptors: 6
• Rotatable Bonds: 18
• Heavy Atoms: 186
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	2388.07
LogP ≤ 5	50.30
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	6

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of N-(4-dibenzothiophen-4-ylphenyl)-N-(4-phenylphenyl)phenanthren-4-amine;N-(9,9-dimethylfluoren-2-yl)-N-[4-(9-phenylcarbazol-3-yl)phenyl]phenanthren-4-amine;N-(2,4-diphenylphenyl)-N-phenylphenanthren-4-amine;N-phenanthren-4-yl-N-phenyl-9,9'-spirobi[fluorene]-2-amine?

The IUPAC name of N-(4-dibenzothiophen-4-ylphenyl)-N-(4-phenylphenyl)phenanthren-4-amine;N-(9,9-dimethylfluoren-2-yl)-N-[4-(9-phenylcarbazol-3-yl)phenyl]phenanthren-4-amine;N-(2,4-diphenylphenyl)-N-phenylphenanthren-4-amine;N-phenanthren-4-yl-N-phenyl-9,9'-spirobi[fluorene]-2-amine (CID 158853787) is N-(4-dibenzothiophen-4-ylphenyl)-N-(4-phenylphenyl)phenanthren-4-amine;N-(9,9-dimethylfluoren-2-yl)-N-[4-(9-phenylcarbazol-3-yl)phenyl]phenanthren-4-amine;N-(2,4-diphenylphenyl)-N-phenylphenanthren-4-amine;N-phenanthren-4-yl-N-phenyl-9,9'-spirobi[fluorene]-2-amine.

What is the SMILES notation for N-(4-dibenzothiophen-4-ylphenyl)-N-(4-phenylphenyl)phenanthren-4-amine;N-(9,9-dimethylfluoren-2-yl)-N-[4-(9-phenylcarbazol-3-yl)phenyl]phenanthren-4-amine;N-(2,4-diphenylphenyl)-N-phenylphenanthren-4-amine;N-phenanthren-4-yl-N-phenyl-9,9'-spirobi[fluorene]-2-amine?

The canonical SMILES for N-(4-dibenzothiophen-4-ylphenyl)-N-(4-phenylphenyl)phenanthren-4-amine;N-(9,9-dimethylfluoren-2-yl)-N-[4-(9-phenylcarbazol-3-yl)phenyl]phenanthren-4-amine;N-(2,4-diphenylphenyl)-N-phenylphenanthren-4-amine;N-phenanthren-4-yl-N-phenyl-9,9'-spirobi[fluorene]-2-amine is CC1(C)c2ccccc2-c2ccc(N(c3ccc(-c4ccc5c(c4)c4ccccc4n5-c4ccccc4)cc3)c3cccc4ccc5ccccc5c34)cc21.c1ccc(-c2ccc(N(c3ccc(-c4cccc5c4sc4ccccc45)cc3)c3cccc4ccc5ccccc5c34)cc2)cc1.c1ccc(-c2ccc(N(c3ccccc3)c3cccc4ccc5ccccc5c34)c(-c3ccccc3)c2)cc1.c1ccc(N(c2ccc3c(c2)C2(c4ccccc4-c4ccccc42)c2ccccc2-3)c2cccc3ccc4ccccc4c23)cc1.

What is the InChIKey of N-(4-dibenzothiophen-4-ylphenyl)-N-(4-phenylphenyl)phenanthren-4-amine;N-(9,9-dimethylfluoren-2-yl)-N-[4-(9-phenylcarbazol-3-yl)phenyl]phenanthren-4-amine;N-(2,4-diphenylphenyl)-N-phenylphenanthren-4-amine;N-phenanthren-4-yl-N-phenyl-9,9'-spirobi[fluorene]-2-amine?

The InChIKey is IZUAHDVPGPHIQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C53H38N2.C45H29N.C44H29NS.C38H27N/c1-53(2)47-20-10-8-18-43(47)44-31-30-41(34-48(44)53)54(51-22-12-14-37-24-23-36-13-6-7-17-42(36)52(37)51)40-28-25-35(26-29-40)38-27-32-50-46(33-38)45-19-9-11-21-49(45)55(50)39-15-4-3-5-16-39;1-2-15-32(16-3-1)46(43-24-12-14-31-26-25-30-13-4-5-17-34(30)44(31)43)33-27-28-38-37-20-8-11-23-41(37)45(42(38)29-33)39-21-9-6-18-35(39)36-19-7-10-22-40(36)45;1-2-10-30(11-3-1)31-22-26-35(27-23-31)45(41-18-8-13-34-21-20-32-12-4-5-14-37(32)43(34)41)36-28-24-33(25-29-36)38-16-9-17-40-39-15-6-7-19-42(39)46-44(38)40;1-4-13-28(14-5-1)32-25-26-36(35(27-32)29-15-6-2-7-16-29)39(33-19-8-3-9-20-33)37-22-12-18-31-24-23-30-17-10-11-21-34(30)38(31)37/h3-34H,1-2H3;2*1-29H;1-27H.

What are the key properties of N-(4-dibenzothiophen-4-ylphenyl)-N-(4-phenylphenyl)phenanthren-4-amine;N-(9,9-dimethylfluoren-2-yl)-N-[4-(9-phenylcarbazol-3-yl)phenyl]phenanthren-4-amine;N-(2,4-diphenylphenyl)-N-phenylphenanthren-4-amine;N-phenanthren-4-yl-N-phenyl-9,9'-spirobi[fluorene]-2-amine?

N-(4-dibenzothiophen-4-ylphenyl)-N-(4-phenylphenyl)phenanthren-4-amine;N-(9,9-dimethylfluoren-2-yl)-N-[4-(9-phenylcarbazol-3-yl)phenyl]phenanthren-4-amine;N-(2,4-diphenylphenyl)-N-phenylphenanthren-4-amine;N-phenanthren-4-yl-N-phenyl-9,9'-spirobi[fluorene]-2-amine has a molecular weight of 2388.07 g/mol, XLogP of 50.30, 18 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for N-(4-dibenzothiophen-4-ylphenyl)-N-(4-phenylphenyl)phenanthren-4-amine;N-(9,9-dimethylfluoren-2-yl)-N-[4-(9-phenylcarbazol-3-yl)phenyl]phenanthren-4-amine;N-(2,4-diphenylphenyl)-N-phenylphenanthren-4-amine;N-phenanthren-4-yl-N-phenyl-9,9'-spirobi[fluorene]-2-amine is sourced from PubChem (CID 158853787), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).