N-(2,4-diphenylphenyl)-6-[6-[5-(N-(2,4-diphenylphenyl)anilino)-2-pyridinyl]pyren-1-yl]-N-phenylpyridin-3-amine;N-phenyl-N-(2-phenylphenyl)-6-[6-[5-(N-(2-phenylphenyl)anilino)-2-pyridinyl]pyren-1-yl]pyridin-3-amine

C136H92N8 — CID 158007003

About N-(2,4-diphenylphenyl)-6-[6-[5-(N-(2,4-diphenylphenyl)anilino)-2-pyridinyl]pyren-1-yl]-N-phenylpyridin-3-amine;N-phenyl-N-(2-phenylphenyl)-6-[6-[5-(N-(2-phenylphenyl)anilino)-2-pyridinyl]pyren-1-yl]pyridin-3-amine

N-(2,4-diphenylphenyl)-6-[6-[5-(N-(2,4-diphenylphenyl)anilino)-2-pyridinyl]pyren-1-yl]-N-phenylpyridin-3-amine;N-phenyl-N-(2-phenylphenyl)-6-[6-[5-(N-(2-phenylphenyl)anilino)-2-pyridinyl]pyren-1-yl]pyridin-3-amine (PubChem CID 158007003) has the molecular formula C136H92N8 and a molecular weight of 1838.29 g/mol. Its IUPAC name is N-(2,4-diphenylphenyl)-6-[6-[5-(N-(2,4-diphenylphenyl)anilino)-2-pyridinyl]pyren-1-yl]-N-phenylpyridin-3-amine;N-phenyl-N-(2-phenylphenyl)-6-[6-[5-(N-(2-phenylphenyl)anilino)-2-pyridinyl]pyren-1-yl]pyridin-3-amine.

Molecular Properties

• Compound Name: N-(2,4-diphenylphenyl)-6-[6-[5-(N-(2,4-diphenylphenyl)anilino)-2-pyridinyl]pyren-1-yl]-N-phenylpyridin-3-amine;N-phenyl-N-(2-phenylphenyl)-6-[6-[5-(N-(2-phenylphenyl)anilino)-2-pyridinyl]pyren-1-yl]pyridin-3-amine
• PubChem CID: 158007003
• Molecular Formula: C136H92N8
• Molecular Weight: 1838.29 g/mol
• Exact Mass: 1836.74
• IUPAC Name: N-(2,4-diphenylphenyl)-6-[6-[5-(N-(2,4-diphenylphenyl)anilino)-2-pyridinyl]pyren-1-yl]-N-phenylpyridin-3-amine;N-phenyl-N-(2-phenylphenyl)-6-[6-[5-(N-(2-phenylphenyl)anilino)-2-pyridinyl]pyren-1-yl]pyridin-3-amine
• SMILES: c1ccc(-c2ccc(N(c3ccccc3)c3ccc(-c4ccc5ccc6c(-c7ccc(N(c8ccccc8)c8ccc(-c9ccccc9)cc8-c8ccccc8)cn7)ccc7ccc4c5c76)nc3)c(-c3ccccc3)c2)cc1.c1ccc(-c2ccccc2N(c2ccccc2)c2ccc(-c3ccc4ccc5c(-c6ccc(N(c7ccccc7)c7ccccc7-c7ccccc7)cn6)ccc6ccc3c4c65)nc2)cc1
• InChI: InChI=1S/C74H50N4.C62H42N4/c1-7-19-51(20-8-1)57-35-45-71(67(47-57)53-23-11-3-12-24-53)77(59-27-15-5-16-28-59)61-37-43-69(75-49-61)63-39-31-55-34-42-66-64(40-32-56-33-41-65(63)73(55)74(56)66)70-44-38-62(50-76-70)78(60-29-17-6-18-30-60)72-46-36-58(52-21-9-2-10-22-52)48-68(72)54-25-13-4-14-26-54;1-5-17-43(18-6-1)51-25-13-15-27-59(51)65(47-21-9-3-10-22-47)49-33-39-57(63-41-49)53-35-29-45-32-38-56-54(36-30-46-31-37-55(53)61(45)62(46)56)58-40-34-50(42-64-58)66(48-23-11-4-12-24-48)60-28-16-14-26-52(60)44-19-7-2-8-20-44/h1-50H;1-42H
• InChIKey: FEKJIYPHVKBEOI-UHFFFAOYSA-N
• XLogP: 37.30
• TPSA: 64.52 Ų
• H-Bond Acceptors: 8
• Rotatable Bonds: 22
• Heavy Atoms: 144
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1838.29
LogP ≤ 5	37.30
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	8

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of N-(2,4-diphenylphenyl)-6-[6-[5-(N-(2,4-diphenylphenyl)anilino)-2-pyridinyl]pyren-1-yl]-N-phenylpyridin-3-amine;N-phenyl-N-(2-phenylphenyl)-6-[6-[5-(N-(2-phenylphenyl)anilino)-2-pyridinyl]pyren-1-yl]pyridin-3-amine?

The IUPAC name of N-(2,4-diphenylphenyl)-6-[6-[5-(N-(2,4-diphenylphenyl)anilino)-2-pyridinyl]pyren-1-yl]-N-phenylpyridin-3-amine;N-phenyl-N-(2-phenylphenyl)-6-[6-[5-(N-(2-phenylphenyl)anilino)-2-pyridinyl]pyren-1-yl]pyridin-3-amine (CID 158007003) is N-(2,4-diphenylphenyl)-6-[6-[5-(N-(2,4-diphenylphenyl)anilino)-2-pyridinyl]pyren-1-yl]-N-phenylpyridin-3-amine;N-phenyl-N-(2-phenylphenyl)-6-[6-[5-(N-(2-phenylphenyl)anilino)-2-pyridinyl]pyren-1-yl]pyridin-3-amine.

What is the SMILES notation for N-(2,4-diphenylphenyl)-6-[6-[5-(N-(2,4-diphenylphenyl)anilino)-2-pyridinyl]pyren-1-yl]-N-phenylpyridin-3-amine;N-phenyl-N-(2-phenylphenyl)-6-[6-[5-(N-(2-phenylphenyl)anilino)-2-pyridinyl]pyren-1-yl]pyridin-3-amine?

The canonical SMILES for N-(2,4-diphenylphenyl)-6-[6-[5-(N-(2,4-diphenylphenyl)anilino)-2-pyridinyl]pyren-1-yl]-N-phenylpyridin-3-amine;N-phenyl-N-(2-phenylphenyl)-6-[6-[5-(N-(2-phenylphenyl)anilino)-2-pyridinyl]pyren-1-yl]pyridin-3-amine is c1ccc(-c2ccc(N(c3ccccc3)c3ccc(-c4ccc5ccc6c(-c7ccc(N(c8ccccc8)c8ccc(-c9ccccc9)cc8-c8ccccc8)cn7)ccc7ccc4c5c76)nc3)c(-c3ccccc3)c2)cc1.c1ccc(-c2ccccc2N(c2ccccc2)c2ccc(-c3ccc4ccc5c(-c6ccc(N(c7ccccc7)c7ccccc7-c7ccccc7)cn6)ccc6ccc3c4c65)nc2)cc1.

What is the InChIKey of N-(2,4-diphenylphenyl)-6-[6-[5-(N-(2,4-diphenylphenyl)anilino)-2-pyridinyl]pyren-1-yl]-N-phenylpyridin-3-amine;N-phenyl-N-(2-phenylphenyl)-6-[6-[5-(N-(2-phenylphenyl)anilino)-2-pyridinyl]pyren-1-yl]pyridin-3-amine?

The InChIKey is FEKJIYPHVKBEOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C74H50N4.C62H42N4/c1-7-19-51(20-8-1)57-35-45-71(67(47-57)53-23-11-3-12-24-53)77(59-27-15-5-16-28-59)61-37-43-69(75-49-61)63-39-31-55-34-42-66-64(40-32-56-33-41-65(63)73(55)74(56)66)70-44-38-62(50-76-70)78(60-29-17-6-18-30-60)72-46-36-58(52-21-9-2-10-22-52)48-68(72)54-25-13-4-14-26-54;1-5-17-43(18-6-1)51-25-13-15-27-59(51)65(47-21-9-3-10-22-47)49-33-39-57(63-41-49)53-35-29-45-32-38-56-54(36-30-46-31-37-55(53)61(45)62(46)56)58-40-34-50(42-64-58)66(48-23-11-4-12-24-48)60-28-16-14-26-52(60)44-19-7-2-8-20-44/h1-50H;1-42H.

What are the key properties of N-(2,4-diphenylphenyl)-6-[6-[5-(N-(2,4-diphenylphenyl)anilino)-2-pyridinyl]pyren-1-yl]-N-phenylpyridin-3-amine;N-phenyl-N-(2-phenylphenyl)-6-[6-[5-(N-(2-phenylphenyl)anilino)-2-pyridinyl]pyren-1-yl]pyridin-3-amine?

N-(2,4-diphenylphenyl)-6-[6-[5-(N-(2,4-diphenylphenyl)anilino)-2-pyridinyl]pyren-1-yl]-N-phenylpyridin-3-amine;N-phenyl-N-(2-phenylphenyl)-6-[6-[5-(N-(2-phenylphenyl)anilino)-2-pyridinyl]pyren-1-yl]pyridin-3-amine has a molecular weight of 1838.29 g/mol, XLogP of 37.30, 22 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.

Where does this data come from?

All data for N-(2,4-diphenylphenyl)-6-[6-[5-(N-(2,4-diphenylphenyl)anilino)-2-pyridinyl]pyren-1-yl]-N-phenylpyridin-3-amine;N-phenyl-N-(2-phenylphenyl)-6-[6-[5-(N-(2-phenylphenyl)anilino)-2-pyridinyl]pyren-1-yl]pyridin-3-amine is sourced from PubChem (CID 158007003), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).