N-(9,9-diphenylfluoren-2-yl)-N-phenyl-7-triphenylsilyldibenzofuran-3-amine

C61H43NOSi — CID 140852979

IUPACN-(9,9-diphenylfluoren-2-yl)-N-phenyl-7-triphenylsilyldibenzofuran-3-amine
SMILESc1ccc(N(c2ccc3c(c2)C(c2ccccc2)(c2ccccc2)c2ccccc2-3)c2ccc3c(c2)oc2cc([Si](c4ccccc4)(c4ccccc4)c4ccccc4)ccc23)cc1
InChIInChI=1S/C61H43NOSi/c1-7-21-44(22-8-1)61(45-23-9-2-10-24-45)57-34-20-19-33-53(57)54-38-35-47(41-58(54)61)62(46-25-11-3-12-26-46)48-36-39-55-56-40-37-52(43-60(56)63-59(55)42-48)64(49-27-13-4-14-28-49,50-29-15-5-16-30-50)51-31-17-6-18-32-51/h1-43H
InChIKeyHLWJIDSPSVGORO-UHFFFAOYSA-N
MW834.11 g/mol
LogP12.80
Rot. Bonds9

About N-(9,9-diphenylfluoren-2-yl)-N-phenyl-7-triphenylsilyldibenzofuran-3-amine

N-(9,9-diphenylfluoren-2-yl)-N-phenyl-7-triphenylsilyldibenzofuran-3-amine (PubChem CID 140852979) has the molecular formula C61H43NOSi and a molecular weight of 834.11 g/mol. Its IUPAC name is N-(9,9-diphenylfluoren-2-yl)-N-phenyl-7-triphenylsilyldibenzofuran-3-amine.

Molecular Properties

Compound NameN-(9,9-diphenylfluoren-2-yl)-N-phenyl-7-triphenylsilyldibenzofuran-3-amine
PubChem CID140852979
Molecular FormulaC61H43NOSi
Molecular Weight834.11 g/mol
Exact Mass833.31
IUPAC NameN-(9,9-diphenylfluoren-2-yl)-N-phenyl-7-triphenylsilyldibenzofuran-3-amine
SMILESc1ccc(N(c2ccc3c(c2)C(c2ccccc2)(c2ccccc2)c2ccccc2-3)c2ccc3c(c2)oc2cc([Si](c4ccccc4)(c4ccccc4)c4ccccc4)ccc23)cc1
InChIInChI=1S/C61H43NOSi/c1-7-21-44(22-8-1)61(45-23-9-2-10-24-45)57-34-20-19-33-53(57)54-38-35-47(41-58(54)61)62(46-25-11-3-12-26-46)48-36-39-55-56-40-37-52(43-60(56)63-59(55)42-48)64(49-27-13-4-14-28-49,50-29-15-5-16-30-50)51-31-17-6-18-32-51/h1-43H
InChIKeyHLWJIDSPSVGORO-UHFFFAOYSA-N
XLogP12.80
TPSA16.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms64
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500834.11
LogP ≤ 512.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'triphenyl_methyl-silyl', 'substructure': 'N/A'}

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Related Compounds

8-N,22-N-bis(9,9-diphenylfluoren-2-yl)-8-N,22-N-bis(4-fluorophenyl)-5,15,25-trioxaheptacyclo[14.11.0.02,14.04,12.06,11.018,26.019,24]heptacosa-1(16),2(14),3,6(11),7,9,12,17,19(24),20,22,26-dodecaene-8,22-diamine
CID 165026586
N,N-bis(4-naphthalen-1-ylphenyl)-4-phenylaniline;N-(4-naphthalen-1-ylphenyl)-N-[4-(4-triphenylsilylphenyl)phenyl]dibenzofuran-3-amine;3-(9-phenylfluoren-9-yl)-N,N-bis(4-phenylphenyl)aniline;4-phenyl-N-(4-phenylphenyl)-N-[4-(4-triphenylsilylphenyl)phenyl]aniline
CID 163659146
7-N,19-N-di(dibenzofuran-3-yl)-7-N,19-N,10,10,22,22-hexakis-phenylhexacyclo[11.11.0.03,11.04,9.015,23.016,21]tetracosa-1,3(11),4(9),5,7,12,14,16(21),17,19,23-undecaene-7,19-diamine
CID 163556957
N-(9-dibenzofuran-2-yl-9-phenylfluoren-2-yl)-N,9,9-triphenylfluoren-2-amine
CID 134452942
4-(4-dibenzofuran-3-ylphenyl)-N-[4-(9,9-diphenylfluoren-2-yl)phenyl]-N-phenylaniline
CID 67964130
1-N,3-N,5-N-tris(9,9-diphenylfluoren-2-yl)-1-N,3-N,5-N-triphenylbenzene-1,3,5-triamine
CID 132601190
N-(10,10-diphenyl-17-pentacyclo[11.8.0.03,11.04,9.014,19]henicosa-1,3(11),4,6,8,12,14(19),15,17,20-decaenyl)-N-phenyldibenzofuran-3-amine
CID 168740238
N-(9,9-dimethylfluoren-2-yl)-7-[7-[N-(9,9-dimethylfluoren-2-yl)-4-(9,9-diphenylspiro[anthracene-10,9'-fluorene]-2'-yl)anilino]-9,9-dimethylfluoren-2-yl]-N-[4-(9,9-dimethylspiro[anthracene-10,9'-fluorene]-2'-yl)phenyl]dibenzofuran-3-amine
CID 146540137
3-N-dibenzofuran-1-yl-1-N-dibenzofuran-3-yl-3-N-(9,9-diphenylfluoren-2-yl)-1-N-(9,9-diphenylfluoren-3-yl)benzene-1,3-diamine
CID 155312532
N,7-diphenyl-N-[3-(9-phenylfluoren-9-yl)phenyl]dibenzofuran-3-amine;N,7-diphenyl-N-[4-(9-phenylfluoren-9-yl)phenyl]dibenzofuran-3-amine;N,7-diphenyl-N-[4-[3-(9-phenylfluoren-9-yl)phenyl]phenyl]dibenzofuran-3-amine;N,7-diphenyl-N-[4-[4-(9-phenylfluoren-9-yl)phenyl]phenyl]dibenzofuran-3-amine
CID 163960848
N-dibenzofuran-3-yl-N-[9,9-dimethyl-7-(9-phenylfluoren-9-yl)fluoren-2-yl]dibenzofuran-3-amine
CID 140919912
N-[4-(9,9-diphenylfluoren-2-yl)phenyl]-N-(9-methyl-9-phenylfluoren-2-yl)dibenzofuran-3-amine
CID 171453577

Frequently Asked Questions

What is the IUPAC name of N-(9,9-diphenylfluoren-2-yl)-N-phenyl-7-triphenylsilyldibenzofuran-3-amine?
The IUPAC name of N-(9,9-diphenylfluoren-2-yl)-N-phenyl-7-triphenylsilyldibenzofuran-3-amine (CID 140852979) is N-(9,9-diphenylfluoren-2-yl)-N-phenyl-7-triphenylsilyldibenzofuran-3-amine.
What is the SMILES notation for N-(9,9-diphenylfluoren-2-yl)-N-phenyl-7-triphenylsilyldibenzofuran-3-amine?
The canonical SMILES for N-(9,9-diphenylfluoren-2-yl)-N-phenyl-7-triphenylsilyldibenzofuran-3-amine is c1ccc(N(c2ccc3c(c2)C(c2ccccc2)(c2ccccc2)c2ccccc2-3)c2ccc3c(c2)oc2cc([Si](c4ccccc4)(c4ccccc4)c4ccccc4)ccc23)cc1.
What is the InChIKey of N-(9,9-diphenylfluoren-2-yl)-N-phenyl-7-triphenylsilyldibenzofuran-3-amine?
The InChIKey is HLWJIDSPSVGORO-UHFFFAOYSA-N. The full InChI is InChI=1S/C61H43NOSi/c1-7-21-44(22-8-1)61(45-23-9-2-10-24-45)57-34-20-19-33-53(57)54-38-35-47(41-58(54)61)62(46-25-11-3-12-26-46)48-36-39-55-56-40-37-52(43-60(56)63-59(55)42-48)64(49-27-13-4-14-28-49,50-29-15-5-16-30-50)51-31-17-6-18-32-51/h1-43H.
What are the key properties of N-(9,9-diphenylfluoren-2-yl)-N-phenyl-7-triphenylsilyldibenzofuran-3-amine?
N-(9,9-diphenylfluoren-2-yl)-N-phenyl-7-triphenylsilyldibenzofuran-3-amine has a molecular weight of 834.11 g/mol, XLogP of 12.80, 9 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(9,9-diphenylfluoren-2-yl)-N-phenyl-7-triphenylsilyldibenzofuran-3-amine is sourced from PubChem (CID 140852979), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).