N-phenyl-N-[4-[4-[4-[4-[4-(4-phenylphenyl)-N-spiro[fluorene-9,9'-hexacyclo[10.10.1.02,10.03,8.013,18.019,23]tricosa-1(23),2(10),3,5,7,11,13,15,17,19,21-undecaene]-1-ylanilino]phenyl]phenyl]phenyl]phenyl]spiro[fluorene-9,23'-hexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2,4,6,8,10,12,14,16(24),17,19,21-dodecaene]-1-amine

C120H74N2 — CID 134528583

About N-phenyl-N-[4-[4-[4-[4-[4-(4-phenylphenyl)-N-spiro[fluorene-9,9'-hexacyclo[10.10.1.02,10.03,8.013,18.019,23]tricosa-1(23),2(10),3,5,7,11,13,15,17,19,21-undecaene]-1-ylanilino]phenyl]phenyl]phenyl]phenyl]spiro[fluorene-9,23'-hexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2,4,6,8,10,12,14,16(24),17,19,21-dodecaene]-1-amine

N-phenyl-N-[4-[4-[4-[4-[4-(4-phenylphenyl)-N-spiro[fluorene-9,9'-hexacyclo[10.10.1.02,10.03,8.013,18.019,23]tricosa-1(23),2(10),3,5,7,11,13,15,17,19,21-undecaene]-1-ylanilino]phenyl]phenyl]phenyl]phenyl]spiro[fluorene-9,23'-hexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2,4,6,8,10,12,14,16(24),17,19,21-dodecaene]-1-amine (PubChem CID 134528583) has the molecular formula C120H74N2 and a molecular weight of 1543.93 g/mol. Its IUPAC name is N-phenyl-N-[4-[4-[4-[4-[4-(4-phenylphenyl)-N-spiro[fluorene-9,9'-hexacyclo[10.10.1.02,10.03,8.013,18.019,23]tricosa-1(23),2(10),3,5,7,11,13,15,17,19,21-undecaene]-1-ylanilino]phenyl]phenyl]phenyl]phenyl]spiro[fluorene-9,23'-hexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2,4,6,8,10,12,14,16(24),17,19,21-dodecaene]-1-amine.

Molecular Properties

• Compound Name: N-phenyl-N-[4-[4-[4-[4-[4-(4-phenylphenyl)-N-spiro[fluorene-9,9'-hexacyclo[10.10.1.02,10.03,8.013,18.019,23]tricosa-1(23),2(10),3,5,7,11,13,15,17,19,21-undecaene]-1-ylanilino]phenyl]phenyl]phenyl]phenyl]spiro[fluorene-9,23'-hexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2,4,6,8,10,12,14,16(24),17,19,21-dodecaene]-1-amine
• PubChem CID: 134528583
• Molecular Formula: C120H74N2
• Molecular Weight: 1543.93 g/mol
• Exact Mass: 1542.59
• IUPAC Name: N-phenyl-N-[4-[4-[4-[4-[4-(4-phenylphenyl)-N-spiro[fluorene-9,9'-hexacyclo[10.10.1.02,10.03,8.013,18.019,23]tricosa-1(23),2(10),3,5,7,11,13,15,17,19,21-undecaene]-1-ylanilino]phenyl]phenyl]phenyl]phenyl]spiro[fluorene-9,23'-hexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2,4,6,8,10,12,14,16(24),17,19,21-dodecaene]-1-amine
• SMILES: c1ccc(-c2ccc(-c3ccc(N(c4ccc(-c5ccc(-c6ccc(-c7ccc(N(c8ccccc8)c8cccc9c8C8(c%10ccccc%10-c%10cc%11c%12ccccc%12c%12ccccc%12c%11cc%108)c8ccccc8-9)cc7)cc6)cc5)cc4)c4cccc5c4C4(c6ccccc6-5)c5ccccc5-c5c4cc4c6c(cccc56)-c5ccccc5-4)cc3)cc2)cc1
• InChI: InChI=1S/C120H74N2/c1-3-24-75(25-4-1)76-48-50-79(51-49-76)83-62-68-87(69-63-83)122(114-47-23-40-100-96-35-14-18-43-108(96)120(118(100)114)110-45-20-16-37-101(110)116-102-41-21-38-98-91-30-9-12-33-94(91)106(115(98)102)74-112(116)120)88-70-64-84(65-71-88)81-58-54-78(55-59-81)77-52-56-80(57-53-77)82-60-66-86(67-61-82)121(85-26-5-2-6-27-85)113-46-22-39-99-95-34-13-17-42-107(95)119(117(99)113)109-44-19-15-36-97(109)105-72-103-92-31-10-7-28-89(92)90-29-8-11-32-93(90)104(103)73-111(105)119/h1-74H
• InChIKey: DUKPBMDFHDYZNI-UHFFFAOYSA-N
• XLogP: 31.91
• TPSA: 6.48 Ų
• H-Bond Acceptors: 2
• Rotatable Bonds: 11
• Heavy Atoms: 122
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1543.93
LogP ≤ 5	31.91
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	2

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of N-phenyl-N-[4-[4-[4-[4-[4-(4-phenylphenyl)-N-spiro[fluorene-9,9'-hexacyclo[10.10.1.02,10.03,8.013,18.019,23]tricosa-1(23),2(10),3,5,7,11,13,15,17,19,21-undecaene]-1-ylanilino]phenyl]phenyl]phenyl]phenyl]spiro[fluorene-9,23'-hexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2,4,6,8,10,12,14,16(24),17,19,21-dodecaene]-1-amine?

The IUPAC name of N-phenyl-N-[4-[4-[4-[4-[4-(4-phenylphenyl)-N-spiro[fluorene-9,9'-hexacyclo[10.10.1.02,10.03,8.013,18.019,23]tricosa-1(23),2(10),3,5,7,11,13,15,17,19,21-undecaene]-1-ylanilino]phenyl]phenyl]phenyl]phenyl]spiro[fluorene-9,23'-hexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2,4,6,8,10,12,14,16(24),17,19,21-dodecaene]-1-amine (CID 134528583) is N-phenyl-N-[4-[4-[4-[4-[4-(4-phenylphenyl)-N-spiro[fluorene-9,9'-hexacyclo[10.10.1.02,10.03,8.013,18.019,23]tricosa-1(23),2(10),3,5,7,11,13,15,17,19,21-undecaene]-1-ylanilino]phenyl]phenyl]phenyl]phenyl]spiro[fluorene-9,23'-hexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2,4,6,8,10,12,14,16(24),17,19,21-dodecaene]-1-amine.

What is the SMILES notation for N-phenyl-N-[4-[4-[4-[4-[4-(4-phenylphenyl)-N-spiro[fluorene-9,9'-hexacyclo[10.10.1.02,10.03,8.013,18.019,23]tricosa-1(23),2(10),3,5,7,11,13,15,17,19,21-undecaene]-1-ylanilino]phenyl]phenyl]phenyl]phenyl]spiro[fluorene-9,23'-hexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2,4,6,8,10,12,14,16(24),17,19,21-dodecaene]-1-amine?

The canonical SMILES for N-phenyl-N-[4-[4-[4-[4-[4-(4-phenylphenyl)-N-spiro[fluorene-9,9'-hexacyclo[10.10.1.02,10.03,8.013,18.019,23]tricosa-1(23),2(10),3,5,7,11,13,15,17,19,21-undecaene]-1-ylanilino]phenyl]phenyl]phenyl]phenyl]spiro[fluorene-9,23'-hexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2,4,6,8,10,12,14,16(24),17,19,21-dodecaene]-1-amine is c1ccc(-c2ccc(-c3ccc(N(c4ccc(-c5ccc(-c6ccc(-c7ccc(N(c8ccccc8)c8cccc9c8C8(c%10ccccc%10-c%10cc%11c%12ccccc%12c%12ccccc%12c%11cc%108)c8ccccc8-9)cc7)cc6)cc5)cc4)c4cccc5c4C4(c6ccccc6-5)c5ccccc5-c5c4cc4c6c(cccc56)-c5ccccc5-4)cc3)cc2)cc1.

What is the InChIKey of N-phenyl-N-[4-[4-[4-[4-[4-(4-phenylphenyl)-N-spiro[fluorene-9,9'-hexacyclo[10.10.1.02,10.03,8.013,18.019,23]tricosa-1(23),2(10),3,5,7,11,13,15,17,19,21-undecaene]-1-ylanilino]phenyl]phenyl]phenyl]phenyl]spiro[fluorene-9,23'-hexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2,4,6,8,10,12,14,16(24),17,19,21-dodecaene]-1-amine?

The InChIKey is DUKPBMDFHDYZNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C120H74N2/c1-3-24-75(25-4-1)76-48-50-79(51-49-76)83-62-68-87(69-63-83)122(114-47-23-40-100-96-35-14-18-43-108(96)120(118(100)114)110-45-20-16-37-101(110)116-102-41-21-38-98-91-30-9-12-33-94(91)106(115(98)102)74-112(116)120)88-70-64-84(65-71-88)81-58-54-78(55-59-81)77-52-56-80(57-53-77)82-60-66-86(67-61-82)121(85-26-5-2-6-27-85)113-46-22-39-99-95-34-13-17-42-107(95)119(117(99)113)109-44-19-15-36-97(109)105-72-103-92-31-10-7-28-89(92)90-29-8-11-32-93(90)104(103)73-111(105)119/h1-74H.

What are the key properties of N-phenyl-N-[4-[4-[4-[4-[4-(4-phenylphenyl)-N-spiro[fluorene-9,9'-hexacyclo[10.10.1.02,10.03,8.013,18.019,23]tricosa-1(23),2(10),3,5,7,11,13,15,17,19,21-undecaene]-1-ylanilino]phenyl]phenyl]phenyl]phenyl]spiro[fluorene-9,23'-hexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2,4,6,8,10,12,14,16(24),17,19,21-dodecaene]-1-amine?

N-phenyl-N-[4-[4-[4-[4-[4-(4-phenylphenyl)-N-spiro[fluorene-9,9'-hexacyclo[10.10.1.02,10.03,8.013,18.019,23]tricosa-1(23),2(10),3,5,7,11,13,15,17,19,21-undecaene]-1-ylanilino]phenyl]phenyl]phenyl]phenyl]spiro[fluorene-9,23'-hexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2,4,6,8,10,12,14,16(24),17,19,21-dodecaene]-1-amine has a molecular weight of 1543.93 g/mol, XLogP of 31.91, 11 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.

Where does this data come from?

All data for N-phenyl-N-[4-[4-[4-[4-[4-(4-phenylphenyl)-N-spiro[fluorene-9,9'-hexacyclo[10.10.1.02,10.03,8.013,18.019,23]tricosa-1(23),2(10),3,5,7,11,13,15,17,19,21-undecaene]-1-ylanilino]phenyl]phenyl]phenyl]phenyl]spiro[fluorene-9,23'-hexacyclo[12.11.0.02,7.08,13.016,24.017,22]pentacosa-1(25),2,4,6,8,10,12,14,16(24),17,19,21-dodecaene]-1-amine is sourced from PubChem (CID 134528583), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).