N-dibenzofuran-2-yl-6-phenyl-N-(2-phenylphenyl)spiro[fluorene-9,9'-xanthene]-2-amine

C55H35NO2 — CID 171766798

IUPACN-dibenzofuran-2-yl-6-phenyl-N-(2-phenylphenyl)spiro[fluorene-9,9'-xanthene]-2-amine
SMILESc1ccc(-c2ccc3c(c2)-c2ccc(N(c4ccc5oc6ccccc6c5c4)c4ccccc4-c4ccccc4)cc2C32c3ccccc3Oc3ccccc32)cc1
InChIInChI=1S/C55H35NO2/c1-3-15-36(16-4-1)38-27-31-46-44(33-38)42-30-28-40(35-49(42)55(46)47-21-9-13-25-53(47)58-54-26-14-10-22-48(54)55)56(50-23-11-7-19-41(50)37-17-5-2-6-18-37)39-29-32-52-45(34-39)43-20-8-12-24-51(43)57-52/h1-35H
InChIKeyDWLPUBJWHRPCME-UHFFFAOYSA-N
MW741.89 g/mol
LogP14.86
Rot. Bonds5

About N-dibenzofuran-2-yl-6-phenyl-N-(2-phenylphenyl)spiro[fluorene-9,9'-xanthene]-2-amine

N-dibenzofuran-2-yl-6-phenyl-N-(2-phenylphenyl)spiro[fluorene-9,9'-xanthene]-2-amine (PubChem CID 171766798) has the molecular formula C55H35NO2 and a molecular weight of 741.89 g/mol. Its IUPAC name is N-dibenzofuran-2-yl-6-phenyl-N-(2-phenylphenyl)spiro[fluorene-9,9'-xanthene]-2-amine.

Molecular Properties

Compound NameN-dibenzofuran-2-yl-6-phenyl-N-(2-phenylphenyl)spiro[fluorene-9,9'-xanthene]-2-amine
PubChem CID171766798
Molecular FormulaC55H35NO2
Molecular Weight741.89 g/mol
Exact Mass741.27
IUPAC NameN-dibenzofuran-2-yl-6-phenyl-N-(2-phenylphenyl)spiro[fluorene-9,9'-xanthene]-2-amine
SMILESc1ccc(-c2ccc3c(c2)-c2ccc(N(c4ccc5oc6ccccc6c5c4)c4ccccc4-c4ccccc4)cc2C32c3ccccc3Oc3ccccc32)cc1
InChIInChI=1S/C55H35NO2/c1-3-15-36(16-4-1)38-27-31-46-44(33-38)42-30-28-40(35-49(42)55(46)47-21-9-13-25-53(47)58-54-26-14-10-22-48(54)55)56(50-23-11-7-19-41(50)37-17-5-2-6-18-37)39-29-32-52-45(34-39)43-20-8-12-24-51(43)57-52/h1-35H
InChIKeyDWLPUBJWHRPCME-UHFFFAOYSA-N
XLogP14.86
TPSA25.61 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms58
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500741.89
LogP ≤ 514.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(4-phenylphenyl)phenyl]-N-(4-spiro[fluorene-9,9'-xanthene]-3-ylphenyl)spiro[fluorene-9,9'-xanthene]-2-amine
CID 138477446
N-(4-dibenzofuran-3-ylphenyl)-N-(2-phenylphenyl)-9,9'-spirobi[fluorene]-2-amine
CID 164784270
N-(4-dibenzofuran-2-ylphenyl)-9,9-bis(4-phenylphenyl)-N-[2-(4-phenylphenyl)phenyl]fluoren-2-amine
CID 122675393
N-(4-heptacyclo[11.10.1.11,8.02,7.017,24.018,23.012,25]pentacosa-2(7),3,5,8,10,12(25),13,15,17(24),18,20,22-dodecaenyl)-N-(2-phenylphenyl)dibenzofuran-2-amine
CID 156664742
N-[2-(4-phenylphenyl)phenyl]-N-spiro[fluorene-9,9'-xanthene]-3'-ylspiro[fluorene-9,9'-xanthene]-2-amine
CID 138477897
N-(9,9-dimethylfluoren-2-yl)-N-spiro[fluorene-9,2'-tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,9,11,13-heptaene]-3-yldibenzofuran-2-amine;N-(2-phenylphenyl)-N-spiro[fluorene-9,2'-tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,9,11,13-heptaene]-3-yldibenzofuran-2-amine;N-(4-phenylphenyl)-N-(4-spiro[fluorene-9,2'-tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,9,11,13-heptaene]-3-ylphenyl)dibenzofuran-2-amine
CID 161132318
N,N-bis(2-phenylphenyl)spiro[fluoreno[3,2-b][1]benzofuran-11,14'-tetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8(13),9,11,15,17-nonaene]-11'-amine
CID 130463062
N-(2-phenylphenyl)-N-[3-(4-phenylphenyl)phenyl]spiro[fluorene-9,9'-xanthene]-2-amine
CID 167177160
N-dibenzofuran-2-yl-N-spiro[fluorene-9,9'-xanthene]-2-ylspiro[fluorene-9,9'-xanthene]-2-amine
CID 138476872
N-(2-phenylphenyl)-N-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'-yldibenzofuran-3-amine;N-(4-phenylphenyl)-N-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'-yldibenzofuran-3-amine;N-(4-phenylphenyl)-N-(4-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'-ylphenyl)dibenzofuran-3-amine
CID 157361279
N-(9,9-dimethylfluoren-2-yl)-N-[2-(4-phenylphenyl)phenyl]spiro[fluoreno[2,3-b][1]benzofuran-7,14'-tetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8(13),9,11,15,17-nonaene]-11'-amine
CID 130462998
N-(14-oxatetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8(13),9,11,15,17-nonaen-10-yl)-N-(2-phenylphenyl)spiro[fluoreno[2,3-b][1]benzofuran-7,14'-tetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8(13),9,11,15,17-nonaene]-10'-amine;N-(14-oxatetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8(13),9,11,15,17-nonaen-10-yl)-N-(4-phenylphenyl)spiro[fluoreno[2,3-b][1]benzofuran-7,14'-tetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8(13),9,11,15,17-nonaene]-10'-amine;N-(14-oxatetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8(13),9,11,15,17-nonaen-10-yl)-N-phenylspiro[fluoreno[2,3-b][1]benzofuran-7,14'-tetracyclo[13.4.0.02,7.08,13]nonadeca-1(19),2,4,6,8(13),9,11,15,17-nonaene]-10'-amine
CID 158121747

Frequently Asked Questions

What is the IUPAC name of N-dibenzofuran-2-yl-6-phenyl-N-(2-phenylphenyl)spiro[fluorene-9,9'-xanthene]-2-amine?
The IUPAC name of N-dibenzofuran-2-yl-6-phenyl-N-(2-phenylphenyl)spiro[fluorene-9,9'-xanthene]-2-amine (CID 171766798) is N-dibenzofuran-2-yl-6-phenyl-N-(2-phenylphenyl)spiro[fluorene-9,9'-xanthene]-2-amine.
What is the SMILES notation for N-dibenzofuran-2-yl-6-phenyl-N-(2-phenylphenyl)spiro[fluorene-9,9'-xanthene]-2-amine?
The canonical SMILES for N-dibenzofuran-2-yl-6-phenyl-N-(2-phenylphenyl)spiro[fluorene-9,9'-xanthene]-2-amine is c1ccc(-c2ccc3c(c2)-c2ccc(N(c4ccc5oc6ccccc6c5c4)c4ccccc4-c4ccccc4)cc2C32c3ccccc3Oc3ccccc32)cc1.
What is the InChIKey of N-dibenzofuran-2-yl-6-phenyl-N-(2-phenylphenyl)spiro[fluorene-9,9'-xanthene]-2-amine?
The InChIKey is DWLPUBJWHRPCME-UHFFFAOYSA-N. The full InChI is InChI=1S/C55H35NO2/c1-3-15-36(16-4-1)38-27-31-46-44(33-38)42-30-28-40(35-49(42)55(46)47-21-9-13-25-53(47)58-54-26-14-10-22-48(54)55)56(50-23-11-7-19-41(50)37-17-5-2-6-18-37)39-29-32-52-45(34-39)43-20-8-12-24-51(43)57-52/h1-35H.
What are the key properties of N-dibenzofuran-2-yl-6-phenyl-N-(2-phenylphenyl)spiro[fluorene-9,9'-xanthene]-2-amine?
N-dibenzofuran-2-yl-6-phenyl-N-(2-phenylphenyl)spiro[fluorene-9,9'-xanthene]-2-amine has a molecular weight of 741.89 g/mol, XLogP of 14.86, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-dibenzofuran-2-yl-6-phenyl-N-(2-phenylphenyl)spiro[fluorene-9,9'-xanthene]-2-amine is sourced from PubChem (CID 171766798), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).