2-N,7-N-dinaphthalen-2-yl-9,9-diphenyl-2-N,7-N-bis(4-trimethylsilylphenyl)fluorene-2,7-diamine

C63H56N2Si2 — CID 123150757

IUPAC2-N,7-N-dinaphthalen-2-yl-9,9-diphenyl-2-N,7-N-bis(4-trimethylsilylphenyl)fluorene-2,7-diamine
SMILESC[Si](C)(C)c1ccc(N(c2ccc3c(c2)C(c2ccccc2)(c2ccccc2)c2cc(N(c4ccc([Si](C)(C)C)cc4)c4ccc5ccccc5c4)ccc2-3)c2ccc3ccccc3c2)cc1
InChIInChI=1S/C63H56N2Si2/c1-66(2,3)57-35-29-51(30-36-57)64(53-27-25-45-17-13-15-19-47(45)41-53)55-33-39-59-60-40-34-56(44-62(60)63(61(59)43-55,49-21-9-7-10-22-49)50-23-11-8-12-24-50)65(52-31-37-58(38-32-52)67(4,5)6)54-28-26-46-18-14-16-20-48(46)42-54/h7-44H,1-6H3
InChIKeyUQTIKVBVDCYYON-UHFFFAOYSA-N
MW897.33 g/mol
LogP16.39
Rot. Bonds10

About 2-N,7-N-dinaphthalen-2-yl-9,9-diphenyl-2-N,7-N-bis(4-trimethylsilylphenyl)fluorene-2,7-diamine

2-N,7-N-dinaphthalen-2-yl-9,9-diphenyl-2-N,7-N-bis(4-trimethylsilylphenyl)fluorene-2,7-diamine (PubChem CID 123150757) has the molecular formula C63H56N2Si2 and a molecular weight of 897.33 g/mol. Its IUPAC name is 2-N,7-N-dinaphthalen-2-yl-9,9-diphenyl-2-N,7-N-bis(4-trimethylsilylphenyl)fluorene-2,7-diamine.

Molecular Properties

Compound Name2-N,7-N-dinaphthalen-2-yl-9,9-diphenyl-2-N,7-N-bis(4-trimethylsilylphenyl)fluorene-2,7-diamine
PubChem CID123150757
Molecular FormulaC63H56N2Si2
Molecular Weight897.33 g/mol
Exact Mass896.40
IUPAC Name2-N,7-N-dinaphthalen-2-yl-9,9-diphenyl-2-N,7-N-bis(4-trimethylsilylphenyl)fluorene-2,7-diamine
SMILESC[Si](C)(C)c1ccc(N(c2ccc3c(c2)C(c2ccccc2)(c2ccccc2)c2cc(N(c4ccc([Si](C)(C)C)cc4)c4ccc5ccccc5c4)ccc2-3)c2ccc3ccccc3c2)cc1
InChIInChI=1S/C63H56N2Si2/c1-66(2,3)57-35-29-51(30-36-57)64(53-27-25-45-17-13-15-19-47(45)41-53)55-33-39-59-60-40-34-56(44-62(60)63(61(59)43-55,49-21-9-7-10-22-49)50-23-11-8-12-24-50)65(52-31-37-58(38-32-52)67(4,5)6)54-28-26-46-18-14-16-20-48(46)42-54/h7-44H,1-6H3
InChIKeyUQTIKVBVDCYYON-UHFFFAOYSA-N
XLogP16.39
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms67
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500897.33
LogP ≤ 516.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-[4-[4-[(9,9-diphenylfluoren-2-yl)-naphthalen-2-ylamino]phenyl]phenyl]-N-naphthalen-2-yl-9,9-diphenylfluoren-2-amine
CID 122448831
N-(9,9-diphenylfluoren-3-yl)-N-naphthalen-2-yl-9,9'-spirobi[fluorene]-2-amine
CID 121423646
11,11-dimethyl-2-N,8-N-diphenyl-2-N,8-N-bis(4-trimethylsilylphenyl)benzo[b]fluorene-2,8-diamine
CID 140774313
N-[4-[4-[4-(N-phenylanilino)phenyl]phenyl]phenyl]-N-(4-trimethylsilylphenyl)naphthalen-2-amine
CID 165040481
6-N,16-N-bis(9,9-diphenylfluoren-2-yl)-6-N,16-N-diphenylpentacyclo[10.8.0.02,11.04,9.014,19]icosa-1(12),2(11),3,5,7,9,13,15,17,19-decaene-6,16-diamine
CID 166033580
3,3,19,19-tetramethyl-16-N-naphthalen-2-yl-6-N,16-N-diphenyl-6-N-(4-trimethylsilylphenyl)-11-oxapentacyclo[10.7.0.02,10.04,9.013,18]nonadeca-1(12),2(10),4(9),5,7,13(18),14,16-octaene-6,16-diamine
CID 140749932
N-[4-(9,9-diphenylfluoren-2-yl)phenyl]-N-phenylnaphthalen-2-amine
CID 58988737
N-[4-[3-(3-naphthalen-2-ylphenyl)phenyl]phenyl]-9,9-diphenyl-N-(4-phenylphenyl)fluoren-2-amine
CID 166566308
N-(4-naphthalen-2-ylphenyl)-9,9-diphenyl-N-(4-phenylphenyl)spiro[anthracene-10,9'-fluorene]-2'-amine
CID 146540100
N-naphthalen-2-yl-N-(4-phenanthren-3-ylphenyl)-9,9-diphenylfluoren-2-amine
CID 142589076
N-(9,9-diphenylfluoren-2-yl)-N-phenylspiro[benzo[b]fluorene-11,9'-fluorene]-2-amine
CID 134193981
7,7-diphenyl-5-N,9-N-bis(4-propan-2-ylphenyl)-5-N,9-N-bis(4-trimethylsilylphenyl)benzo[c]fluorene-5,9-diamine
CID 140717796

Frequently Asked Questions

What is the IUPAC name of 2-N,7-N-dinaphthalen-2-yl-9,9-diphenyl-2-N,7-N-bis(4-trimethylsilylphenyl)fluorene-2,7-diamine?
The IUPAC name of 2-N,7-N-dinaphthalen-2-yl-9,9-diphenyl-2-N,7-N-bis(4-trimethylsilylphenyl)fluorene-2,7-diamine (CID 123150757) is 2-N,7-N-dinaphthalen-2-yl-9,9-diphenyl-2-N,7-N-bis(4-trimethylsilylphenyl)fluorene-2,7-diamine.
What is the SMILES notation for 2-N,7-N-dinaphthalen-2-yl-9,9-diphenyl-2-N,7-N-bis(4-trimethylsilylphenyl)fluorene-2,7-diamine?
The canonical SMILES for 2-N,7-N-dinaphthalen-2-yl-9,9-diphenyl-2-N,7-N-bis(4-trimethylsilylphenyl)fluorene-2,7-diamine is C[Si](C)(C)c1ccc(N(c2ccc3c(c2)C(c2ccccc2)(c2ccccc2)c2cc(N(c4ccc([Si](C)(C)C)cc4)c4ccc5ccccc5c4)ccc2-3)c2ccc3ccccc3c2)cc1.
What is the InChIKey of 2-N,7-N-dinaphthalen-2-yl-9,9-diphenyl-2-N,7-N-bis(4-trimethylsilylphenyl)fluorene-2,7-diamine?
The InChIKey is UQTIKVBVDCYYON-UHFFFAOYSA-N. The full InChI is InChI=1S/C63H56N2Si2/c1-66(2,3)57-35-29-51(30-36-57)64(53-27-25-45-17-13-15-19-47(45)41-53)55-33-39-59-60-40-34-56(44-62(60)63(61(59)43-55,49-21-9-7-10-22-49)50-23-11-8-12-24-50)65(52-31-37-58(38-32-52)67(4,5)6)54-28-26-46-18-14-16-20-48(46)42-54/h7-44H,1-6H3.
What are the key properties of 2-N,7-N-dinaphthalen-2-yl-9,9-diphenyl-2-N,7-N-bis(4-trimethylsilylphenyl)fluorene-2,7-diamine?
2-N,7-N-dinaphthalen-2-yl-9,9-diphenyl-2-N,7-N-bis(4-trimethylsilylphenyl)fluorene-2,7-diamine has a molecular weight of 897.33 g/mol, XLogP of 16.39, 10 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N,7-N-dinaphthalen-2-yl-9,9-diphenyl-2-N,7-N-bis(4-trimethylsilylphenyl)fluorene-2,7-diamine is sourced from PubChem (CID 123150757), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).