N-[4-[4-(N-[4-[1,1,1,3,3,3-hexafluoro-2-[4-(N-[4-[4-[(1-methylcyclohexa-2,4-dien-1-yl)-naphthalen-1-ylamino]phenyl]phenyl]anilino)phenyl]propan-2-yl]phenyl]anilino)phenyl]phenyl]-N-phenylnaphthalen-1-amine

C84H62F6N4 — CID 143120722

About N-[4-[4-(N-[4-[1,1,1,3,3,3-hexafluoro-2-[4-(N-[4-[4-[(1-methylcyclohexa-2,4-dien-1-yl)-naphthalen-1-ylamino]phenyl]phenyl]anilino)phenyl]propan-2-yl]phenyl]anilino)phenyl]phenyl]-N-phenylnaphthalen-1-amine

N-[4-[4-(N-[4-[1,1,1,3,3,3-hexafluoro-2-[4-(N-[4-[4-[(1-methylcyclohexa-2,4-dien-1-yl)-naphthalen-1-ylamino]phenyl]phenyl]anilino)phenyl]propan-2-yl]phenyl]anilino)phenyl]phenyl]-N-phenylnaphthalen-1-amine (PubChem CID 143120722) has the molecular formula C84H62F6N4 and a molecular weight of 1241.44 g/mol. Its IUPAC name is N-[4-[4-(N-[4-[1,1,1,3,3,3-hexafluoro-2-[4-(N-[4-[4-[(1-methylcyclohexa-2,4-dien-1-yl)-naphthalen-1-ylamino]phenyl]phenyl]anilino)phenyl]propan-2-yl]phenyl]anilino)phenyl]phenyl]-N-phenylnaphthalen-1-amine.

Molecular Properties

• Compound Name: N-[4-[4-(N-[4-[1,1,1,3,3,3-hexafluoro-2-[4-(N-[4-[4-[(1-methylcyclohexa-2,4-dien-1-yl)-naphthalen-1-ylamino]phenyl]phenyl]anilino)phenyl]propan-2-yl]phenyl]anilino)phenyl]phenyl]-N-phenylnaphthalen-1-amine
• PubChem CID: 143120722
• Molecular Formula: C84H62F6N4
• Molecular Weight: 1241.44 g/mol
• Exact Mass: 1240.49
• IUPAC Name: N-[4-[4-(N-[4-[1,1,1,3,3,3-hexafluoro-2-[4-(N-[4-[4-[(1-methylcyclohexa-2,4-dien-1-yl)-naphthalen-1-ylamino]phenyl]phenyl]anilino)phenyl]propan-2-yl]phenyl]anilino)phenyl]phenyl]-N-phenylnaphthalen-1-amine
• SMILES: CC1(N(c2ccc(-c3ccc(N(c4ccccc4)c4ccc(C(c5ccc(N(c6ccccc6)c6ccc(-c7ccc(N(c8ccccc8)c8cccc9ccccc89)cc7)cc6)cc5)(C(F)(F)F)C(F)(F)F)cc4)cc3)cc2)c2cccc3ccccc23)C=CC=CC1
• InChI: InChI=1S/C84H62F6N4/c1-81(58-16-5-17-59-81)94(80-33-19-23-65-21-13-15-31-78(65)80)76-52-40-63(41-53-76)61-36-48-72(49-37-61)92(69-26-8-3-9-27-69)74-56-44-67(45-57-74)82(83(85,86)87,84(88,89)90)66-42-54-73(55-43-66)91(68-24-6-2-7-25-68)71-46-34-60(35-47-71)62-38-50-75(51-39-62)93(70-28-10-4-11-29-70)79-32-18-22-64-20-12-14-30-77(64)79/h2-58H,59H2,1H3
• InChIKey: ICAVZURDEPJBJK-UHFFFAOYSA-N
• XLogP: 24.56
• TPSA: 12.96 Ų
• H-Bond Acceptors: 4
• Rotatable Bonds: 16
• Heavy Atoms: 94
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1241.44
LogP ≤ 5	24.56
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	4

Frequently Asked Questions

What is the IUPAC name of N-[4-[4-(N-[4-[1,1,1,3,3,3-hexafluoro-2-[4-(N-[4-[4-[(1-methylcyclohexa-2,4-dien-1-yl)-naphthalen-1-ylamino]phenyl]phenyl]anilino)phenyl]propan-2-yl]phenyl]anilino)phenyl]phenyl]-N-phenylnaphthalen-1-amine?

The IUPAC name of N-[4-[4-(N-[4-[1,1,1,3,3,3-hexafluoro-2-[4-(N-[4-[4-[(1-methylcyclohexa-2,4-dien-1-yl)-naphthalen-1-ylamino]phenyl]phenyl]anilino)phenyl]propan-2-yl]phenyl]anilino)phenyl]phenyl]-N-phenylnaphthalen-1-amine (CID 143120722) is N-[4-[4-(N-[4-[1,1,1,3,3,3-hexafluoro-2-[4-(N-[4-[4-[(1-methylcyclohexa-2,4-dien-1-yl)-naphthalen-1-ylamino]phenyl]phenyl]anilino)phenyl]propan-2-yl]phenyl]anilino)phenyl]phenyl]-N-phenylnaphthalen-1-amine.

What is the SMILES notation for N-[4-[4-(N-[4-[1,1,1,3,3,3-hexafluoro-2-[4-(N-[4-[4-[(1-methylcyclohexa-2,4-dien-1-yl)-naphthalen-1-ylamino]phenyl]phenyl]anilino)phenyl]propan-2-yl]phenyl]anilino)phenyl]phenyl]-N-phenylnaphthalen-1-amine?

The canonical SMILES for N-[4-[4-(N-[4-[1,1,1,3,3,3-hexafluoro-2-[4-(N-[4-[4-[(1-methylcyclohexa-2,4-dien-1-yl)-naphthalen-1-ylamino]phenyl]phenyl]anilino)phenyl]propan-2-yl]phenyl]anilino)phenyl]phenyl]-N-phenylnaphthalen-1-amine is CC1(N(c2ccc(-c3ccc(N(c4ccccc4)c4ccc(C(c5ccc(N(c6ccccc6)c6ccc(-c7ccc(N(c8ccccc8)c8cccc9ccccc89)cc7)cc6)cc5)(C(F)(F)F)C(F)(F)F)cc4)cc3)cc2)c2cccc3ccccc23)C=CC=CC1.

What is the InChIKey of N-[4-[4-(N-[4-[1,1,1,3,3,3-hexafluoro-2-[4-(N-[4-[4-[(1-methylcyclohexa-2,4-dien-1-yl)-naphthalen-1-ylamino]phenyl]phenyl]anilino)phenyl]propan-2-yl]phenyl]anilino)phenyl]phenyl]-N-phenylnaphthalen-1-amine?

The InChIKey is ICAVZURDEPJBJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C84H62F6N4/c1-81(58-16-5-17-59-81)94(80-33-19-23-65-21-13-15-31-78(65)80)76-52-40-63(41-53-76)61-36-48-72(49-37-61)92(69-26-8-3-9-27-69)74-56-44-67(45-57-74)82(83(85,86)87,84(88,89)90)66-42-54-73(55-43-66)91(68-24-6-2-7-25-68)71-46-34-60(35-47-71)62-38-50-75(51-39-62)93(70-28-10-4-11-29-70)79-32-18-22-64-20-12-14-30-77(64)79/h2-58H,59H2,1H3.

What are the key properties of N-[4-[4-(N-[4-[1,1,1,3,3,3-hexafluoro-2-[4-(N-[4-[4-[(1-methylcyclohexa-2,4-dien-1-yl)-naphthalen-1-ylamino]phenyl]phenyl]anilino)phenyl]propan-2-yl]phenyl]anilino)phenyl]phenyl]-N-phenylnaphthalen-1-amine?

N-[4-[4-(N-[4-[1,1,1,3,3,3-hexafluoro-2-[4-(N-[4-[4-[(1-methylcyclohexa-2,4-dien-1-yl)-naphthalen-1-ylamino]phenyl]phenyl]anilino)phenyl]propan-2-yl]phenyl]anilino)phenyl]phenyl]-N-phenylnaphthalen-1-amine has a molecular weight of 1241.44 g/mol, XLogP of 24.56, 16 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for N-[4-[4-(N-[4-[1,1,1,3,3,3-hexafluoro-2-[4-(N-[4-[4-[(1-methylcyclohexa-2,4-dien-1-yl)-naphthalen-1-ylamino]phenyl]phenyl]anilino)phenyl]propan-2-yl]phenyl]anilino)phenyl]phenyl]-N-phenylnaphthalen-1-amine is sourced from PubChem (CID 143120722), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).