N-[4-[4-[4-[3-[10-[4-[4-[4-[3-[10-[3,5-diphenyl-N-(9,9'-spirobi[fluorene]-2-yl)anilino]phenanthren-9-yl]phenyl]phenyl]phenyl]-3-phenyl-N-(9,9'-spirobi[fluorene]-2-yl)anilino]phenanthren-9-yl]phenyl]phenyl]-2-phenylphenyl]phenyl]-N-[10-(4-phenylphenyl)phenanthren-9-yl]-9,9'-spirobi[fluorene]-2-amine

C207H131N3 — CID 155304160

IUPACN-[4-[4-[4-[3-[10-[4-[4-[4-[3-[10-[3,5-diphenyl-N-(9,9'-spirobi[fluorene]-2-yl)anilino]phenanthren-9-yl]phenyl]phenyl]phenyl]-3-phenyl-N-(9,9'-spirobi[fluorene]-2-yl)anilino]phenanthren-9-yl]phenyl]phenyl]-2-phenylphenyl]phenyl]-N-[10-(4-phenylphenyl)phenanthren-9-yl]-9,9'-spirobi[fluorene]-2-amine
SMILESc1ccc(-c2ccc(-c3c(N(c4ccc(-c5ccc(-c6ccc(-c7cccc(-c8c(N(c9ccc(-c%10ccc(-c%11ccc(-c%12cccc(-c%13c(N(c%14cc(-c%15ccccc%15)cc(-c%15ccccc%15)c%14)c%14ccc%15c(c%14)C%14(c%16ccccc%16-c%16ccccc%16%14)c%14ccccc%14-%15)c%14ccccc%14c%14ccccc%13%14)c%12)cc%11)cc%10)c(-c%10ccccc%10)c9)c9ccc%10c(c9)C9(c%11ccccc%11-c%11ccccc%119)c9ccccc9-%10)c9ccccc9c9ccccc89)c7)cc6)cc5-c5ccccc5)cc4)c4ccc5c(c4)C4(c6ccccc6-c6ccccc64)c4ccccc4-5)c4ccccc4c4ccccc34)cc2)cc1
InChIInChI=1S/C207H131N3/c1-6-48-132(49-7-1)135-102-106-145(107-103-135)199-179-77-22-16-62-161(179)164-65-19-25-80-182(164)202(199)208(155-114-119-176-173-74-34-43-89-193(173)205(196(176)129-155)187-83-37-28-68-167(187)168-69-29-38-84-188(168)205)153-111-108-144(109-112-153)159-117-110-148(127-185(159)141-54-12-4-13-55-141)140-98-96-139(97-99-140)147-59-46-60-149(122-147)200-180-78-23-17-63-162(180)165-66-20-26-81-183(165)203(200)209(156-115-120-177-174-75-35-44-90-194(174)206(197(177)130-156)189-85-39-30-70-169(189)170-71-31-40-86-190(170)206)154-113-118-160(186(128-154)142-56-14-5-15-57-142)143-104-100-137(101-105-143)136-92-94-138(95-93-136)146-58-47-61-150(123-146)201-181-79-24-18-64-163(181)166-67-21-27-82-184(166)204(201)210(158-125-151(133-50-8-2-9-51-133)124-152(126-158)134-52-10-3-11-53-134)157-116-121-178-175-76-36-45-91-195(175)207(198(178)131-157)191-87-41-32-72-171(191)172-73-33-42-88-192(172)207/h1-131H
InChIKeyZJCSOUGTIWQVHL-UHFFFAOYSA-N
MW2660.35 g/mol
LogP55.38
Rot. Bonds23

About N-[4-[4-[4-[3-[10-[4-[4-[4-[3-[10-[3,5-diphenyl-N-(9,9'-spirobi[fluorene]-2-yl)anilino]phenanthren-9-yl]phenyl]phenyl]phenyl]-3-phenyl-N-(9,9'-spirobi[fluorene]-2-yl)anilino]phenanthren-9-yl]phenyl]phenyl]-2-phenylphenyl]phenyl]-N-[10-(4-phenylphenyl)phenanthren-9-yl]-9,9'-spirobi[fluorene]-2-amine

N-[4-[4-[4-[3-[10-[4-[4-[4-[3-[10-[3,5-diphenyl-N-(9,9'-spirobi[fluorene]-2-yl)anilino]phenanthren-9-yl]phenyl]phenyl]phenyl]-3-phenyl-N-(9,9'-spirobi[fluorene]-2-yl)anilino]phenanthren-9-yl]phenyl]phenyl]-2-phenylphenyl]phenyl]-N-[10-(4-phenylphenyl)phenanthren-9-yl]-9,9'-spirobi[fluorene]-2-amine (PubChem CID 155304160) has the molecular formula C207H131N3 and a molecular weight of 2660.35 g/mol. Its IUPAC name is N-[4-[4-[4-[3-[10-[4-[4-[4-[3-[10-[3,5-diphenyl-N-(9,9'-spirobi[fluorene]-2-yl)anilino]phenanthren-9-yl]phenyl]phenyl]phenyl]-3-phenyl-N-(9,9'-spirobi[fluorene]-2-yl)anilino]phenanthren-9-yl]phenyl]phenyl]-2-phenylphenyl]phenyl]-N-[10-(4-phenylphenyl)phenanthren-9-yl]-9,9'-spirobi[fluorene]-2-amine.

Molecular Properties

Compound NameN-[4-[4-[4-[3-[10-[4-[4-[4-[3-[10-[3,5-diphenyl-N-(9,9'-spirobi[fluorene]-2-yl)anilino]phenanthren-9-yl]phenyl]phenyl]phenyl]-3-phenyl-N-(9,9'-spirobi[fluorene]-2-yl)anilino]phenanthren-9-yl]phenyl]phenyl]-2-phenylphenyl]phenyl]-N-[10-(4-phenylphenyl)phenanthren-9-yl]-9,9'-spirobi[fluorene]-2-amine
PubChem CID155304160
Molecular FormulaC207H131N3
Molecular Weight2660.35 g/mol
Exact Mass2658.03
IUPAC NameN-[4-[4-[4-[3-[10-[4-[4-[4-[3-[10-[3,5-diphenyl-N-(9,9'-spirobi[fluorene]-2-yl)anilino]phenanthren-9-yl]phenyl]phenyl]phenyl]-3-phenyl-N-(9,9'-spirobi[fluorene]-2-yl)anilino]phenanthren-9-yl]phenyl]phenyl]-2-phenylphenyl]phenyl]-N-[10-(4-phenylphenyl)phenanthren-9-yl]-9,9'-spirobi[fluorene]-2-amine
SMILESc1ccc(-c2ccc(-c3c(N(c4ccc(-c5ccc(-c6ccc(-c7cccc(-c8c(N(c9ccc(-c%10ccc(-c%11ccc(-c%12cccc(-c%13c(N(c%14cc(-c%15ccccc%15)cc(-c%15ccccc%15)c%14)c%14ccc%15c(c%14)C%14(c%16ccccc%16-c%16ccccc%16%14)c%14ccccc%14-%15)c%14ccccc%14c%14ccccc%13%14)c%12)cc%11)cc%10)c(-c%10ccccc%10)c9)c9ccc%10c(c9)C9(c%11ccccc%11-c%11ccccc%119)c9ccccc9-%10)c9ccccc9c9ccccc89)c7)cc6)cc5-c5ccccc5)cc4)c4ccc5c(c4)C4(c6ccccc6-c6ccccc64)c4ccccc4-5)c4ccccc4c4ccccc34)cc2)cc1
InChIInChI=1S/C207H131N3/c1-6-48-132(49-7-1)135-102-106-145(107-103-135)199-179-77-22-16-62-161(179)164-65-19-25-80-182(164)202(199)208(155-114-119-176-173-74-34-43-89-193(173)205(196(176)129-155)187-83-37-28-68-167(187)168-69-29-38-84-188(168)205)153-111-108-144(109-112-153)159-117-110-148(127-185(159)141-54-12-4-13-55-141)140-98-96-139(97-99-140)147-59-46-60-149(122-147)200-180-78-23-17-63-162(180)165-66-20-26-81-183(165)203(200)209(156-115-120-177-174-75-35-44-90-194(174)206(197(177)130-156)189-85-39-30-70-169(189)170-71-31-40-86-190(170)206)154-113-118-160(186(128-154)142-56-14-5-15-57-142)143-104-100-137(101-105-143)136-92-94-138(95-93-136)146-58-47-61-150(123-146)201-181-79-24-18-64-163(181)166-67-21-27-82-184(166)204(201)210(158-125-151(133-50-8-2-9-51-133)124-152(126-158)134-52-10-3-11-53-134)157-116-121-178-175-76-36-45-91-195(175)207(198(178)131-157)191-87-41-32-72-171(191)172-73-33-42-88-192(172)207/h1-131H
InChIKeyZJCSOUGTIWQVHL-UHFFFAOYSA-N
XLogP55.38
TPSA9.72 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds23
Heavy Atoms210
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002660.35
LogP ≤ 555.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze N-[4-[4-[4-[3-[10-[4-[4-[4-[3-[10-[3,5-diphenyl-N-(9,9'-spirobi[fluorene]-2-yl)anilino]phenanthren-9-yl]phenyl]phenyl]phenyl]-3-phenyl-N-(9,9'-spirobi[fluorene]-2-yl)anilino]phenanthren-9-yl]phenyl]phenyl]-2-phenylphenyl]phenyl]-N-[10-(4-phenylphenyl)phenanthren-9-yl]-9,9'-spirobi[fluorene]-2-amine with MolForge

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Related Compounds

N-[4-(2,5-diphenylphenyl)phenyl]-N-[10-(2-phenylphenyl)phenanthren-9-yl]-9,9'-spirobi[fluorene]-2-amine
CID 155305027
N-[10-(4-naphthalen-1-ylphenyl)phenanthren-9-yl]-N-[4-[3-[3-[5-[3-[10-[4-(2-phenylphenyl)-N-(9,9'-spirobi[fluorene]-2-yl)anilino]phenanthren-9-yl]phenyl]naphthalen-1-yl]phenyl]phenyl]phenyl]-9,9'-spirobi[fluorene]-2-amine
CID 155305261
N-[10-[3-[6-[2-[3-[4-[4-[[10-[3-(2-phenylphenyl)phenyl]phenanthren-9-yl]-(9,9'-spirobi[fluorene]-2-yl)amino]phenyl]phenyl]phenyl]phenyl]naphthalen-2-yl]phenyl]phenanthren-9-yl]-N-[4-[4-(2-phenylphenyl)phenyl]phenyl]-9,9'-spirobi[fluorene]-2-amine
CID 155305435
N-(10-phenylphenanthren-9-yl)-N-(4-phenylphenyl)-9,9'-spirobi[fluorene]-2-amine
CID 155303553
10-[4-[3-[3-[4-(3,4-diphenylphenyl)-N-[10-[4-[3-[3-[N-[10-(4-phenylphenyl)phenanthren-9-yl]-4-[4-(2-phenylphenyl)phenyl]anilino]phenyl]phenyl]phenyl]phenanthren-9-yl]anilino]phenyl]phenyl]phenyl]-N-phenyl-N-[3-phenyl-4-(4-phenylphenyl)phenyl]phenanthren-9-amine
CID 155305411
N-(9,9-dimethylfluoren-2-yl)-N-(3,4-diphenylphenyl)-10-(3-phenylphenyl)phenanthren-9-amine
CID 155304597
10-phenyl-N-[4-(3-phenylphenyl)phenyl]-N-(7,9,9-triphenylfluoren-2-yl)phenanthren-9-amine
CID 155304182
10-(4-phenylphenyl)-N-[4-(3-phenylphenyl)phenyl]-N-[4-[3-[3-[10-(N-[4-(2-phenylphenyl)phenyl]anilino)phenanthren-9-yl]phenyl]phenyl]phenyl]phenanthren-9-amine
CID 155304845
N-(9,9-dimethylfluoren-2-yl)-10-(4-phenylphenyl)-N-[4-[4-(3-phenylphenyl)phenyl]phenyl]phenanthren-9-amine
CID 155304244
N-(9,9-dimethylfluoren-2-yl)-N-[4-[3-[10-[N-(9,9-dimethylfluoren-2-yl)-4-[4-[4-[3-[10-[N-(9,9-dimethylfluoren-2-yl)-4-(3-phenylphenyl)anilino]phenanthren-9-yl]phenyl]phenyl]phenyl]anilino]phenanthren-9-yl]phenyl]-2-phenylphenyl]-10-phenylphenanthren-9-amine
CID 155305640
10-phenyl-N-(3-phenylphenyl)-N-(7,9,9-triphenylfluoren-2-yl)phenanthren-9-amine
CID 155304163
N-[4-[4-(cyclodecapentaenyl)phenyl]-3-phenylphenyl]-N-(4-phenylphenyl)-9,9'-spirobi[fluorene]-2-amine
CID 134194372

Frequently Asked Questions

What is the IUPAC name of N-[4-[4-[4-[3-[10-[4-[4-[4-[3-[10-[3,5-diphenyl-N-(9,9'-spirobi[fluorene]-2-yl)anilino]phenanthren-9-yl]phenyl]phenyl]phenyl]-3-phenyl-N-(9,9'-spirobi[fluorene]-2-yl)anilino]phenanthren-9-yl]phenyl]phenyl]-2-phenylphenyl]phenyl]-N-[10-(4-phenylphenyl)phenanthren-9-yl]-9,9'-spirobi[fluorene]-2-amine?
The IUPAC name of N-[4-[4-[4-[3-[10-[4-[4-[4-[3-[10-[3,5-diphenyl-N-(9,9'-spirobi[fluorene]-2-yl)anilino]phenanthren-9-yl]phenyl]phenyl]phenyl]-3-phenyl-N-(9,9'-spirobi[fluorene]-2-yl)anilino]phenanthren-9-yl]phenyl]phenyl]-2-phenylphenyl]phenyl]-N-[10-(4-phenylphenyl)phenanthren-9-yl]-9,9'-spirobi[fluorene]-2-amine (CID 155304160) is N-[4-[4-[4-[3-[10-[4-[4-[4-[3-[10-[3,5-diphenyl-N-(9,9'-spirobi[fluorene]-2-yl)anilino]phenanthren-9-yl]phenyl]phenyl]phenyl]-3-phenyl-N-(9,9'-spirobi[fluorene]-2-yl)anilino]phenanthren-9-yl]phenyl]phenyl]-2-phenylphenyl]phenyl]-N-[10-(4-phenylphenyl)phenanthren-9-yl]-9,9'-spirobi[fluorene]-2-amine.
What is the SMILES notation for N-[4-[4-[4-[3-[10-[4-[4-[4-[3-[10-[3,5-diphenyl-N-(9,9'-spirobi[fluorene]-2-yl)anilino]phenanthren-9-yl]phenyl]phenyl]phenyl]-3-phenyl-N-(9,9'-spirobi[fluorene]-2-yl)anilino]phenanthren-9-yl]phenyl]phenyl]-2-phenylphenyl]phenyl]-N-[10-(4-phenylphenyl)phenanthren-9-yl]-9,9'-spirobi[fluorene]-2-amine?
The canonical SMILES for N-[4-[4-[4-[3-[10-[4-[4-[4-[3-[10-[3,5-diphenyl-N-(9,9'-spirobi[fluorene]-2-yl)anilino]phenanthren-9-yl]phenyl]phenyl]phenyl]-3-phenyl-N-(9,9'-spirobi[fluorene]-2-yl)anilino]phenanthren-9-yl]phenyl]phenyl]-2-phenylphenyl]phenyl]-N-[10-(4-phenylphenyl)phenanthren-9-yl]-9,9'-spirobi[fluorene]-2-amine is c1ccc(-c2ccc(-c3c(N(c4ccc(-c5ccc(-c6ccc(-c7cccc(-c8c(N(c9ccc(-c%10ccc(-c%11ccc(-c%12cccc(-c%13c(N(c%14cc(-c%15ccccc%15)cc(-c%15ccccc%15)c%14)c%14ccc%15c(c%14)C%14(c%16ccccc%16-c%16ccccc%16%14)c%14ccccc%14-%15)c%14ccccc%14c%14ccccc%13%14)c%12)cc%11)cc%10)c(-c%10ccccc%10)c9)c9ccc%10c(c9)C9(c%11ccccc%11-c%11ccccc%119)c9ccccc9-%10)c9ccccc9c9ccccc89)c7)cc6)cc5-c5ccccc5)cc4)c4ccc5c(c4)C4(c6ccccc6-c6ccccc64)c4ccccc4-5)c4ccccc4c4ccccc34)cc2)cc1.
What is the InChIKey of N-[4-[4-[4-[3-[10-[4-[4-[4-[3-[10-[3,5-diphenyl-N-(9,9'-spirobi[fluorene]-2-yl)anilino]phenanthren-9-yl]phenyl]phenyl]phenyl]-3-phenyl-N-(9,9'-spirobi[fluorene]-2-yl)anilino]phenanthren-9-yl]phenyl]phenyl]-2-phenylphenyl]phenyl]-N-[10-(4-phenylphenyl)phenanthren-9-yl]-9,9'-spirobi[fluorene]-2-amine?
The InChIKey is ZJCSOUGTIWQVHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C207H131N3/c1-6-48-132(49-7-1)135-102-106-145(107-103-135)199-179-77-22-16-62-161(179)164-65-19-25-80-182(164)202(199)208(155-114-119-176-173-74-34-43-89-193(173)205(196(176)129-155)187-83-37-28-68-167(187)168-69-29-38-84-188(168)205)153-111-108-144(109-112-153)159-117-110-148(127-185(159)141-54-12-4-13-55-141)140-98-96-139(97-99-140)147-59-46-60-149(122-147)200-180-78-23-17-63-162(180)165-66-20-26-81-183(165)203(200)209(156-115-120-177-174-75-35-44-90-194(174)206(197(177)130-156)189-85-39-30-70-169(189)170-71-31-40-86-190(170)206)154-113-118-160(186(128-154)142-56-14-5-15-57-142)143-104-100-137(101-105-143)136-92-94-138(95-93-136)146-58-47-61-150(123-146)201-181-79-24-18-64-163(181)166-67-21-27-82-184(166)204(201)210(158-125-151(133-50-8-2-9-51-133)124-152(126-158)134-52-10-3-11-53-134)157-116-121-178-175-76-36-45-91-195(175)207(198(178)131-157)191-87-41-32-72-171(191)172-73-33-42-88-192(172)207/h1-131H.
What are the key properties of N-[4-[4-[4-[3-[10-[4-[4-[4-[3-[10-[3,5-diphenyl-N-(9,9'-spirobi[fluorene]-2-yl)anilino]phenanthren-9-yl]phenyl]phenyl]phenyl]-3-phenyl-N-(9,9'-spirobi[fluorene]-2-yl)anilino]phenanthren-9-yl]phenyl]phenyl]-2-phenylphenyl]phenyl]-N-[10-(4-phenylphenyl)phenanthren-9-yl]-9,9'-spirobi[fluorene]-2-amine?
N-[4-[4-[4-[3-[10-[4-[4-[4-[3-[10-[3,5-diphenyl-N-(9,9'-spirobi[fluorene]-2-yl)anilino]phenanthren-9-yl]phenyl]phenyl]phenyl]-3-phenyl-N-(9,9'-spirobi[fluorene]-2-yl)anilino]phenanthren-9-yl]phenyl]phenyl]-2-phenylphenyl]phenyl]-N-[10-(4-phenylphenyl)phenanthren-9-yl]-9,9'-spirobi[fluorene]-2-amine has a molecular weight of 2660.35 g/mol, XLogP of 55.38, 23 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[4-[4-[3-[10-[4-[4-[4-[3-[10-[3,5-diphenyl-N-(9,9'-spirobi[fluorene]-2-yl)anilino]phenanthren-9-yl]phenyl]phenyl]phenyl]-3-phenyl-N-(9,9'-spirobi[fluorene]-2-yl)anilino]phenanthren-9-yl]phenyl]phenyl]-2-phenylphenyl]phenyl]-N-[10-(4-phenylphenyl)phenanthren-9-yl]-9,9'-spirobi[fluorene]-2-amine is sourced from PubChem (CID 155304160), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).