6-methyl-N-[4-[10-[4-(N-(6-methyl-9-phenylcarbazol-3-yl)anilino)phenyl]anthracen-9-yl]phenyl]-N,9-diphenylcarbazol-3-amine;N-[4-[3-methyl-10-[4-(N-[9-phenyl-6-(4-phenylphenyl)carbazol-3-yl]anilino)phenyl]anthracen-9-yl]phenyl]-N,9-diphenyl-6-(4-phenylphenyl)carbazol-3-amine

C175H122N8 — CID 158721226

About 6-methyl-N-[4-[10-[4-(N-(6-methyl-9-phenylcarbazol-3-yl)anilino)phenyl]anthracen-9-yl]phenyl]-N,9-diphenylcarbazol-3-amine;N-[4-[3-methyl-10-[4-(N-[9-phenyl-6-(4-phenylphenyl)carbazol-3-yl]anilino)phenyl]anthracen-9-yl]phenyl]-N,9-diphenyl-6-(4-phenylphenyl)carbazol-3-amine

6-methyl-N-[4-[10-[4-(N-(6-methyl-9-phenylcarbazol-3-yl)anilino)phenyl]anthracen-9-yl]phenyl]-N,9-diphenylcarbazol-3-amine;N-[4-[3-methyl-10-[4-(N-[9-phenyl-6-(4-phenylphenyl)carbazol-3-yl]anilino)phenyl]anthracen-9-yl]phenyl]-N,9-diphenyl-6-(4-phenylphenyl)carbazol-3-amine (PubChem CID 158721226) has the molecular formula C175H122N8 and a molecular weight of 2336.96 g/mol. Its IUPAC name is 6-methyl-N-[4-[10-[4-(N-(6-methyl-9-phenylcarbazol-3-yl)anilino)phenyl]anthracen-9-yl]phenyl]-N,9-diphenylcarbazol-3-amine;N-[4-[3-methyl-10-[4-(N-[9-phenyl-6-(4-phenylphenyl)carbazol-3-yl]anilino)phenyl]anthracen-9-yl]phenyl]-N,9-diphenyl-6-(4-phenylphenyl)carbazol-3-amine.

Molecular Properties

• Compound Name: 6-methyl-N-[4-[10-[4-(N-(6-methyl-9-phenylcarbazol-3-yl)anilino)phenyl]anthracen-9-yl]phenyl]-N,9-diphenylcarbazol-3-amine;N-[4-[3-methyl-10-[4-(N-[9-phenyl-6-(4-phenylphenyl)carbazol-3-yl]anilino)phenyl]anthracen-9-yl]phenyl]-N,9-diphenyl-6-(4-phenylphenyl)carbazol-3-amine
• PubChem CID: 158721226
• Molecular Formula: C175H122N8
• Molecular Weight: 2336.96 g/mol
• Exact Mass: 2334.98
• IUPAC Name: 6-methyl-N-[4-[10-[4-(N-(6-methyl-9-phenylcarbazol-3-yl)anilino)phenyl]anthracen-9-yl]phenyl]-N,9-diphenylcarbazol-3-amine;N-[4-[3-methyl-10-[4-(N-[9-phenyl-6-(4-phenylphenyl)carbazol-3-yl]anilino)phenyl]anthracen-9-yl]phenyl]-N,9-diphenyl-6-(4-phenylphenyl)carbazol-3-amine
• SMILES: Cc1ccc2c(-c3ccc(N(c4ccccc4)c4ccc5c(c4)c4cc(-c6ccc(-c7ccccc7)cc6)ccc4n5-c4ccccc4)cc3)c3ccccc3c(-c3ccc(N(c4ccccc4)c4ccc5c(c4)c4cc(-c6ccc(-c7ccccc7)cc6)ccc4n5-c4ccccc4)cc3)c2c1.Cc1ccc2c(c1)c1cc(N(c3ccccc3)c3ccc(-c4c5ccccc5c(-c5ccc(N(c6ccccc6)c6ccc7c(c6)c6cc(C)ccc6n7-c6ccccc6)cc5)c5ccccc45)cc3)ccc1n2-c1ccccc1
• InChI: InChI=1S/C99H68N4.C76H54N4/c1-67-36-57-88-93(62-67)99(75-47-53-83(54-48-75)101(79-28-14-5-15-29-79)85-56-61-97-92(66-85)90-64-77(50-59-95(90)103(97)81-32-18-7-19-33-81)73-43-39-71(40-44-73)69-24-10-3-11-25-69)87-35-21-20-34-86(87)98(88)74-45-51-82(52-46-74)100(78-26-12-4-13-27-78)84-55-60-96-91(65-84)89-63-76(49-58-94(89)102(96)80-30-16-6-17-31-80)72-41-37-70(38-42-72)68-22-8-2-9-23-68;1-51-31-43-71-67(47-51)69-49-61(41-45-73(69)79(71)57-23-11-5-12-24-57)77(55-19-7-3-8-20-55)59-37-33-53(34-38-59)75-63-27-15-17-29-65(63)76(66-30-18-16-28-64(66)75)54-35-39-60(40-36-54)78(56-21-9-4-10-22-56)62-42-46-74-70(50-62)68-48-52(2)32-44-72(68)80(74)58-25-13-6-14-26-58/h2-66H,1H3;3-50H,1-2H3
• InChIKey: IJYBYKLZISSCSV-UHFFFAOYSA-N
• XLogP: 48.51
• TPSA: 32.68 Ų
• H-Bond Acceptors: 8
• Rotatable Bonds: 24
• Heavy Atoms: 183
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	2336.96
LogP ≤ 5	48.51
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	8

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 6-methyl-N-[4-[10-[4-(N-(6-methyl-9-phenylcarbazol-3-yl)anilino)phenyl]anthracen-9-yl]phenyl]-N,9-diphenylcarbazol-3-amine;N-[4-[3-methyl-10-[4-(N-[9-phenyl-6-(4-phenylphenyl)carbazol-3-yl]anilino)phenyl]anthracen-9-yl]phenyl]-N,9-diphenyl-6-(4-phenylphenyl)carbazol-3-amine?

The IUPAC name of 6-methyl-N-[4-[10-[4-(N-(6-methyl-9-phenylcarbazol-3-yl)anilino)phenyl]anthracen-9-yl]phenyl]-N,9-diphenylcarbazol-3-amine;N-[4-[3-methyl-10-[4-(N-[9-phenyl-6-(4-phenylphenyl)carbazol-3-yl]anilino)phenyl]anthracen-9-yl]phenyl]-N,9-diphenyl-6-(4-phenylphenyl)carbazol-3-amine (CID 158721226) is 6-methyl-N-[4-[10-[4-(N-(6-methyl-9-phenylcarbazol-3-yl)anilino)phenyl]anthracen-9-yl]phenyl]-N,9-diphenylcarbazol-3-amine;N-[4-[3-methyl-10-[4-(N-[9-phenyl-6-(4-phenylphenyl)carbazol-3-yl]anilino)phenyl]anthracen-9-yl]phenyl]-N,9-diphenyl-6-(4-phenylphenyl)carbazol-3-amine.

What is the SMILES notation for 6-methyl-N-[4-[10-[4-(N-(6-methyl-9-phenylcarbazol-3-yl)anilino)phenyl]anthracen-9-yl]phenyl]-N,9-diphenylcarbazol-3-amine;N-[4-[3-methyl-10-[4-(N-[9-phenyl-6-(4-phenylphenyl)carbazol-3-yl]anilino)phenyl]anthracen-9-yl]phenyl]-N,9-diphenyl-6-(4-phenylphenyl)carbazol-3-amine?

The canonical SMILES for 6-methyl-N-[4-[10-[4-(N-(6-methyl-9-phenylcarbazol-3-yl)anilino)phenyl]anthracen-9-yl]phenyl]-N,9-diphenylcarbazol-3-amine;N-[4-[3-methyl-10-[4-(N-[9-phenyl-6-(4-phenylphenyl)carbazol-3-yl]anilino)phenyl]anthracen-9-yl]phenyl]-N,9-diphenyl-6-(4-phenylphenyl)carbazol-3-amine is Cc1ccc2c(-c3ccc(N(c4ccccc4)c4ccc5c(c4)c4cc(-c6ccc(-c7ccccc7)cc6)ccc4n5-c4ccccc4)cc3)c3ccccc3c(-c3ccc(N(c4ccccc4)c4ccc5c(c4)c4cc(-c6ccc(-c7ccccc7)cc6)ccc4n5-c4ccccc4)cc3)c2c1.Cc1ccc2c(c1)c1cc(N(c3ccccc3)c3ccc(-c4c5ccccc5c(-c5ccc(N(c6ccccc6)c6ccc7c(c6)c6cc(C)ccc6n7-c6ccccc6)cc5)c5ccccc45)cc3)ccc1n2-c1ccccc1.

What is the InChIKey of 6-methyl-N-[4-[10-[4-(N-(6-methyl-9-phenylcarbazol-3-yl)anilino)phenyl]anthracen-9-yl]phenyl]-N,9-diphenylcarbazol-3-amine;N-[4-[3-methyl-10-[4-(N-[9-phenyl-6-(4-phenylphenyl)carbazol-3-yl]anilino)phenyl]anthracen-9-yl]phenyl]-N,9-diphenyl-6-(4-phenylphenyl)carbazol-3-amine?

The InChIKey is IJYBYKLZISSCSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C99H68N4.C76H54N4/c1-67-36-57-88-93(62-67)99(75-47-53-83(54-48-75)101(79-28-14-5-15-29-79)85-56-61-97-92(66-85)90-64-77(50-59-95(90)103(97)81-32-18-7-19-33-81)73-43-39-71(40-44-73)69-24-10-3-11-25-69)87-35-21-20-34-86(87)98(88)74-45-51-82(52-46-74)100(78-26-12-4-13-27-78)84-55-60-96-91(65-84)89-63-76(49-58-94(89)102(96)80-30-16-6-17-31-80)72-41-37-70(38-42-72)68-22-8-2-9-23-68;1-51-31-43-71-67(47-51)69-49-61(41-45-73(69)79(71)57-23-11-5-12-24-57)77(55-19-7-3-8-20-55)59-37-33-53(34-38-59)75-63-27-15-17-29-65(63)76(66-30-18-16-28-64(66)75)54-35-39-60(40-36-54)78(56-21-9-4-10-22-56)62-42-46-74-70(50-62)68-48-52(2)32-44-72(68)80(74)58-25-13-6-14-26-58/h2-66H,1H3;3-50H,1-2H3.

What are the key properties of 6-methyl-N-[4-[10-[4-(N-(6-methyl-9-phenylcarbazol-3-yl)anilino)phenyl]anthracen-9-yl]phenyl]-N,9-diphenylcarbazol-3-amine;N-[4-[3-methyl-10-[4-(N-[9-phenyl-6-(4-phenylphenyl)carbazol-3-yl]anilino)phenyl]anthracen-9-yl]phenyl]-N,9-diphenyl-6-(4-phenylphenyl)carbazol-3-amine?

6-methyl-N-[4-[10-[4-(N-(6-methyl-9-phenylcarbazol-3-yl)anilino)phenyl]anthracen-9-yl]phenyl]-N,9-diphenylcarbazol-3-amine;N-[4-[3-methyl-10-[4-(N-[9-phenyl-6-(4-phenylphenyl)carbazol-3-yl]anilino)phenyl]anthracen-9-yl]phenyl]-N,9-diphenyl-6-(4-phenylphenyl)carbazol-3-amine has a molecular weight of 2336.96 g/mol, XLogP of 48.51, 24 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.

Where does this data come from?

All data for 6-methyl-N-[4-[10-[4-(N-(6-methyl-9-phenylcarbazol-3-yl)anilino)phenyl]anthracen-9-yl]phenyl]-N,9-diphenylcarbazol-3-amine;N-[4-[3-methyl-10-[4-(N-[9-phenyl-6-(4-phenylphenyl)carbazol-3-yl]anilino)phenyl]anthracen-9-yl]phenyl]-N,9-diphenyl-6-(4-phenylphenyl)carbazol-3-amine is sourced from PubChem (CID 158721226), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).