N,N-bis(4-phenylphenyl)-11'-pyridin-3-ylspiro[fluorene-9,14'-tetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8(13),9,11,15,17-nonaene]-3-amine

C60H40N2 — CID 130263967

IUPACN,N-bis(4-phenylphenyl)-11'-pyridin-3-ylspiro[fluorene-9,14'-tetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8(13),9,11,15,17-nonaene]-3-amine
SMILESc1ccc(-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc4c(c3)-c3ccccc3C43c4ccccc4-c4ccccc4-c4ccc(-c5cccnc5)cc43)cc2)cc1
InChIInChI=1S/C60H40N2/c1-3-14-41(15-4-1)43-25-30-47(31-26-43)62(48-32-27-44(28-33-48)42-16-5-2-6-17-42)49-34-36-58-55(39-49)53-22-10-12-24-57(53)60(58)56-23-11-9-21-52(56)50-19-7-8-20-51(50)54-35-29-45(38-59(54)60)46-18-13-37-61-40-46/h1-40H
InChIKeyHVBHXYURURMFIR-UHFFFAOYSA-N
MW788.99 g/mol
LogP15.56
Rot. Bonds6

About N,N-bis(4-phenylphenyl)-11'-pyridin-3-ylspiro[fluorene-9,14'-tetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8(13),9,11,15,17-nonaene]-3-amine

N,N-bis(4-phenylphenyl)-11'-pyridin-3-ylspiro[fluorene-9,14'-tetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8(13),9,11,15,17-nonaene]-3-amine (PubChem CID 130263967) has the molecular formula C60H40N2 and a molecular weight of 788.99 g/mol. Its IUPAC name is N,N-bis(4-phenylphenyl)-11'-pyridin-3-ylspiro[fluorene-9,14'-tetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8(13),9,11,15,17-nonaene]-3-amine.

Molecular Properties

Compound NameN,N-bis(4-phenylphenyl)-11'-pyridin-3-ylspiro[fluorene-9,14'-tetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8(13),9,11,15,17-nonaene]-3-amine
PubChem CID130263967
Molecular FormulaC60H40N2
Molecular Weight788.99 g/mol
Exact Mass788.32
IUPAC NameN,N-bis(4-phenylphenyl)-11'-pyridin-3-ylspiro[fluorene-9,14'-tetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8(13),9,11,15,17-nonaene]-3-amine
SMILESc1ccc(-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc4c(c3)-c3ccccc3C43c4ccccc4-c4ccccc4-c4ccc(-c5cccnc5)cc43)cc2)cc1
InChIInChI=1S/C60H40N2/c1-3-14-41(15-4-1)43-25-30-47(31-26-43)62(48-32-27-44(28-33-48)42-16-5-2-6-17-42)49-34-36-58-55(39-49)53-22-10-12-24-57(53)60(58)56-23-11-9-21-52(56)50-19-7-8-20-51(50)54-35-29-45(38-59(54)60)46-18-13-37-61-40-46/h1-40H
InChIKeyHVBHXYURURMFIR-UHFFFAOYSA-N
XLogP15.56
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms62
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500788.99
LogP ≤ 515.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze N,N-bis(4-phenylphenyl)-11'-pyridin-3-ylspiro[fluorene-9,14'-tetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8(13),9,11,15,17-nonaene]-3-amine with MolForge

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Related Compounds

2'-[4-(N-phenylanilino)phenyl]-N,N-bis(4-phenylphenyl)-9,9'-spirobi[fluorene]-3-amine
CID 167177680
3-N,3-N,3-N',3-N'-tetrakis(4-phenylphenyl)-9,9'-spirobi[fluorene]-3,3'-diamine
CID 167236339
N-(4-phenylphenyl)-N-[4-(3-phenylphenyl)phenyl]-9,9-dipyridin-3-ylfluoren-2-amine
CID 118245852
N,N-bis[4-(3-phenylphenyl)phenyl]-9,9'-spirobi[fluorene]-3-amine
CID 168750058
N-(4-phenylphenyl)-N-(9,9'-spirobi[fluorene]-2-yl)spiro[fluorene-9,14'-tetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8,10,12,15,17-nonaene]-2-amine
CID 121391582
N,4-diphenyl-N-[4-(9,9'-spirobi[fluorene]-2-yl)phenyl]aniline
CID 122452266
N,N-diphenyl-3-[4-(N-phenylanilino)phenyl]-9,9'-spirobi[fluorene]-2'-amine
CID 121423944
N-phenyl-N-(4-phenylphenyl)spiro[fluorene-9,14'-tetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8(13),9,11,15,17-nonaene]-11'-amine
CID 155079035
N-[4-(3,5-diphenylphenyl)phenyl]-N-(4-phenylphenyl)-9,9'-spirobi[fluorene]-3-amine
CID 166663853
N-(4-phenylphenyl)-N-(9,9'-spirobi[fluorene]-2-yl)-9,9'-spirobi[fluorene]-2-amine
CID 118641092
2-phenyl-4-(4-pyridin-3-ylphenyl)-6-spiro[fluorene-9,14'-tetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8(13),9,11,15,17-nonaene]-11'-yl-1,3,5-triazine
CID 130261378
N-[9,9-dimethyl-7-(4-phenylphenyl)fluoren-2-yl]-N-(4-phenylphenyl)-9,9'-spirobi[fluorene]-3-amine
CID 166663855

Frequently Asked Questions

What is the IUPAC name of N,N-bis(4-phenylphenyl)-11'-pyridin-3-ylspiro[fluorene-9,14'-tetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8(13),9,11,15,17-nonaene]-3-amine?
The IUPAC name of N,N-bis(4-phenylphenyl)-11'-pyridin-3-ylspiro[fluorene-9,14'-tetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8(13),9,11,15,17-nonaene]-3-amine (CID 130263967) is N,N-bis(4-phenylphenyl)-11'-pyridin-3-ylspiro[fluorene-9,14'-tetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8(13),9,11,15,17-nonaene]-3-amine.
What is the SMILES notation for N,N-bis(4-phenylphenyl)-11'-pyridin-3-ylspiro[fluorene-9,14'-tetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8(13),9,11,15,17-nonaene]-3-amine?
The canonical SMILES for N,N-bis(4-phenylphenyl)-11'-pyridin-3-ylspiro[fluorene-9,14'-tetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8(13),9,11,15,17-nonaene]-3-amine is c1ccc(-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3ccc4c(c3)-c3ccccc3C43c4ccccc4-c4ccccc4-c4ccc(-c5cccnc5)cc43)cc2)cc1.
What is the InChIKey of N,N-bis(4-phenylphenyl)-11'-pyridin-3-ylspiro[fluorene-9,14'-tetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8(13),9,11,15,17-nonaene]-3-amine?
The InChIKey is HVBHXYURURMFIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C60H40N2/c1-3-14-41(15-4-1)43-25-30-47(31-26-43)62(48-32-27-44(28-33-48)42-16-5-2-6-17-42)49-34-36-58-55(39-49)53-22-10-12-24-57(53)60(58)56-23-11-9-21-52(56)50-19-7-8-20-51(50)54-35-29-45(38-59(54)60)46-18-13-37-61-40-46/h1-40H.
What are the key properties of N,N-bis(4-phenylphenyl)-11'-pyridin-3-ylspiro[fluorene-9,14'-tetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8(13),9,11,15,17-nonaene]-3-amine?
N,N-bis(4-phenylphenyl)-11'-pyridin-3-ylspiro[fluorene-9,14'-tetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8(13),9,11,15,17-nonaene]-3-amine has a molecular weight of 788.99 g/mol, XLogP of 15.56, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-bis(4-phenylphenyl)-11'-pyridin-3-ylspiro[fluorene-9,14'-tetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8(13),9,11,15,17-nonaene]-3-amine is sourced from PubChem (CID 130263967), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).