N,N-bis(4-phenylphenyl)-3-spiro[adamantane-2,9'-fluorene]-3'-ylaniline;9,9-dimethyl-N-(4-phenylphenyl)-N-(3-spiro[adamantane-2,9'-fluorene]-3'-ylphenyl)fluoren-2-amine;N-(4-phenylphenyl)-N-(3-spiro[adamantane-2,9'-fluorene]-3'-ylphenyl)dibenzofuran-3-amine

C159H131N3O — CID 162212897

IUPACN,N-bis(4-phenylphenyl)-3-spiro[adamantane-2,9'-fluorene]-3'-ylaniline;9,9-dimethyl-N-(4-phenylphenyl)-N-(3-spiro[adamantane-2,9'-fluorene]-3'-ylphenyl)fluoren-2-amine;N-(4-phenylphenyl)-N-(3-spiro[adamantane-2,9'-fluorene]-3'-ylphenyl)dibenzofuran-3-amine
SMILESCC1(C)c2ccccc2-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3cccc(-c4ccc5c(c4)-c4ccccc4C54C5CC6CC(C5)CC4C6)c3)cc21.c1ccc(-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3cccc(-c4ccc5c(c4)-c4ccccc4C54C5CC6CC(C5)CC4C6)c3)cc2)cc1.c1ccc(-c2ccc(N(c3cccc(-c4ccc5c(c4)-c4ccccc4C54C5CC6CC(C5)CC4C6)c3)c3ccc4c(c3)oc3ccccc34)cc2)cc1
InChIInChI=1S/C55H47N.C52H41NO.C52H43N/c1-54(2)50-17-8-6-15-46(50)48-25-24-45(34-53(48)54)56(43-22-19-38(20-23-43)37-11-4-3-5-12-37)44-14-10-13-39(32-44)40-21-26-52-49(33-40)47-16-7-9-18-51(47)55(52)41-28-35-27-36(30-41)31-42(55)29-35;1-2-9-35(10-3-1)36-17-20-41(21-18-36)53(43-22-23-46-45-14-5-7-16-50(45)54-51(46)32-43)42-12-8-11-37(30-42)38-19-24-49-47(31-38)44-13-4-6-15-48(44)52(49)39-26-33-25-34(28-39)29-40(52)27-33;1-3-10-37(11-4-1)39-18-23-45(24-19-39)53(46-25-20-40(21-26-46)38-12-5-2-6-13-38)47-15-9-14-41(33-47)42-22-27-51-49(34-42)48-16-7-8-17-50(48)52(51)43-29-35-28-36(31-43)32-44(52)30-35/h3-26,32-36,41-42H,27-31H2,1-2H3;1-24,30-34,39-40H,25-29H2;1-27,33-36,43-44H,28-32H2
InChIKeyZTBXKQZNANNZHB-UHFFFAOYSA-N
MW2099.82 g/mol
LogP42.51
Rot. Bonds16

About N,N-bis(4-phenylphenyl)-3-spiro[adamantane-2,9'-fluorene]-3'-ylaniline;9,9-dimethyl-N-(4-phenylphenyl)-N-(3-spiro[adamantane-2,9'-fluorene]-3'-ylphenyl)fluoren-2-amine;N-(4-phenylphenyl)-N-(3-spiro[adamantane-2,9'-fluorene]-3'-ylphenyl)dibenzofuran-3-amine

N,N-bis(4-phenylphenyl)-3-spiro[adamantane-2,9'-fluorene]-3'-ylaniline;9,9-dimethyl-N-(4-phenylphenyl)-N-(3-spiro[adamantane-2,9'-fluorene]-3'-ylphenyl)fluoren-2-amine;N-(4-phenylphenyl)-N-(3-spiro[adamantane-2,9'-fluorene]-3'-ylphenyl)dibenzofuran-3-amine (PubChem CID 162212897) has the molecular formula C159H131N3O and a molecular weight of 2099.82 g/mol. Its IUPAC name is N,N-bis(4-phenylphenyl)-3-spiro[adamantane-2,9'-fluorene]-3'-ylaniline;9,9-dimethyl-N-(4-phenylphenyl)-N-(3-spiro[adamantane-2,9'-fluorene]-3'-ylphenyl)fluoren-2-amine;N-(4-phenylphenyl)-N-(3-spiro[adamantane-2,9'-fluorene]-3'-ylphenyl)dibenzofuran-3-amine.

Molecular Properties

Compound NameN,N-bis(4-phenylphenyl)-3-spiro[adamantane-2,9'-fluorene]-3'-ylaniline;9,9-dimethyl-N-(4-phenylphenyl)-N-(3-spiro[adamantane-2,9'-fluorene]-3'-ylphenyl)fluoren-2-amine;N-(4-phenylphenyl)-N-(3-spiro[adamantane-2,9'-fluorene]-3'-ylphenyl)dibenzofuran-3-amine
PubChem CID162212897
Molecular FormulaC159H131N3O
Molecular Weight2099.82 g/mol
Exact Mass2098.03
IUPAC NameN,N-bis(4-phenylphenyl)-3-spiro[adamantane-2,9'-fluorene]-3'-ylaniline;9,9-dimethyl-N-(4-phenylphenyl)-N-(3-spiro[adamantane-2,9'-fluorene]-3'-ylphenyl)fluoren-2-amine;N-(4-phenylphenyl)-N-(3-spiro[adamantane-2,9'-fluorene]-3'-ylphenyl)dibenzofuran-3-amine
SMILESCC1(C)c2ccccc2-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3cccc(-c4ccc5c(c4)-c4ccccc4C54C5CC6CC(C5)CC4C6)c3)cc21.c1ccc(-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3cccc(-c4ccc5c(c4)-c4ccccc4C54C5CC6CC(C5)CC4C6)c3)cc2)cc1.c1ccc(-c2ccc(N(c3cccc(-c4ccc5c(c4)-c4ccccc4C54C5CC6CC(C5)CC4C6)c3)c3ccc4c(c3)oc3ccccc34)cc2)cc1
InChIInChI=1S/C55H47N.C52H41NO.C52H43N/c1-54(2)50-17-8-6-15-46(50)48-25-24-45(34-53(48)54)56(43-22-19-38(20-23-43)37-11-4-3-5-12-37)44-14-10-13-39(32-44)40-21-26-52-49(33-40)47-16-7-9-18-51(47)55(52)41-28-35-27-36(30-41)31-42(55)29-35;1-2-9-35(10-3-1)36-17-20-41(21-18-36)53(43-22-23-46-45-14-5-7-16-50(45)54-51(46)32-43)42-12-8-11-37(30-42)38-19-24-49-47(31-38)44-13-4-6-15-48(44)52(49)39-26-33-25-34(28-39)29-40(52)27-33;1-3-10-37(11-4-1)39-18-23-45(24-19-39)53(46-25-20-40(21-26-46)38-12-5-2-6-13-38)47-15-9-14-41(33-47)42-22-27-51-49(34-42)48-16-7-8-17-50(48)52(51)43-29-35-28-36(31-43)32-44(52)30-35/h3-26,32-36,41-42H,27-31H2,1-2H3;1-24,30-34,39-40H,25-29H2;1-27,33-36,43-44H,28-32H2
InChIKeyZTBXKQZNANNZHB-UHFFFAOYSA-N
XLogP42.51
TPSA22.86 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds16
Heavy Atoms163
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5002099.82
LogP ≤ 542.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze N,N-bis(4-phenylphenyl)-3-spiro[adamantane-2,9'-fluorene]-3'-ylaniline;9,9-dimethyl-N-(4-phenylphenyl)-N-(3-spiro[adamantane-2,9'-fluorene]-3'-ylphenyl)fluoren-2-amine;N-(4-phenylphenyl)-N-(3-spiro[adamantane-2,9'-fluorene]-3'-ylphenyl)dibenzofuran-3-amine with MolForge

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Related Compounds

9,9-dimethyl-N-(4-phenylphenyl)-N-(3-spiro[adamantane-2,9'-fluorene]-3'-ylphenyl)fluoren-2-amine
CID 156567598
N-(9,9-dimethylfluoren-2-yl)-6'-phenyl-N-(3-phenylphenyl)spiro[adamantane-2,9'-fluorene]-3'-amine
CID 170085916
N,N-bis(4-phenylphenyl)-3-spiro[adamantane-2,9'-fluorene]-3'-ylaniline;N-(4-phenylphenyl)-N-(3-spiro[adamantane-2,9'-fluorene]-3'-ylphenyl)dibenzofuran-3-amine;N-(4-phenylphenyl)-N-(3-spiro[adamantane-2,9'-fluorene]-3'-ylphenyl)dibenzothiophen-3-amine
CID 158482387
9,9-dimethyl-N-(4-naphthalen-1-ylphenyl)-N-(4-phenylphenyl)-6-spiro[adamantane-2,9'-fluorene]-3'-ylfluoren-2-amine
CID 156568019
N-(4-dibenzofuran-3-ylphenyl)-3-[3-(9,9-dimethylfluoren-3-yl)phenyl]-N-(4-phenylphenyl)aniline
CID 168839418
N-(3-phenylphenyl)-N-(6-phenylspiro[fluorene-9,2'-tricyclo[3.3.1.03,7]nonane]-3-yl)dibenzofuran-3-amine
CID 170085152
N-(9,9-dimethylfluoren-2-yl)-N-(4-spiro[adamantane-2,9'-fluorene]-4'-ylphenyl)dibenzofuran-3-amine;N,4-diphenyl-N-(4-spiro[adamantane-2,9'-fluorene]-4'-ylphenyl)aniline;N-(2-phenylphenyl)-N-(4-spiro[adamantane-2,9'-fluorene]-4'-ylphenyl)dibenzothiophen-3-amine
CID 159942017
9,9-dimethyl-N-(4-phenylphenyl)-N-(4-spiro[adamantane-2,9'-fluorene]-2'-ylphenyl)fluoren-2-amine
CID 155393680
N-(9,9-dimethylfluoren-2-yl)-N-(4-phenylphenyl)spiro[adamantane-2,9'-fluorene]-2'-amine
CID 155393837
N,N-di(spiro[adamantane-2,9'-fluorene]-2'-yl)dibenzofuran-3-amine
CID 168722758
N-(9,9-dimethylfluoren-2-yl)-6'-phenyl-N-(4-phenylnaphthalen-1-yl)spiro[adamantane-2,9'-fluorene]-3'-amine
CID 171736050
N-(9,9-dimethylfluoren-3-yl)-N-phenylspiro[adamantane-2,9'-fluorene]-2'-amine;N-(3-naphthalen-1-ylphenyl)-N-phenylspiro[adamantane-2,9'-fluorene]-2'-amine;N-(4-phenanthren-2-ylphenyl)-N-phenylspiro[adamantane-2,9'-fluorene]-2'-amine
CID 157226955

Frequently Asked Questions

What is the IUPAC name of N,N-bis(4-phenylphenyl)-3-spiro[adamantane-2,9'-fluorene]-3'-ylaniline;9,9-dimethyl-N-(4-phenylphenyl)-N-(3-spiro[adamantane-2,9'-fluorene]-3'-ylphenyl)fluoren-2-amine;N-(4-phenylphenyl)-N-(3-spiro[adamantane-2,9'-fluorene]-3'-ylphenyl)dibenzofuran-3-amine?
The IUPAC name of N,N-bis(4-phenylphenyl)-3-spiro[adamantane-2,9'-fluorene]-3'-ylaniline;9,9-dimethyl-N-(4-phenylphenyl)-N-(3-spiro[adamantane-2,9'-fluorene]-3'-ylphenyl)fluoren-2-amine;N-(4-phenylphenyl)-N-(3-spiro[adamantane-2,9'-fluorene]-3'-ylphenyl)dibenzofuran-3-amine (CID 162212897) is N,N-bis(4-phenylphenyl)-3-spiro[adamantane-2,9'-fluorene]-3'-ylaniline;9,9-dimethyl-N-(4-phenylphenyl)-N-(3-spiro[adamantane-2,9'-fluorene]-3'-ylphenyl)fluoren-2-amine;N-(4-phenylphenyl)-N-(3-spiro[adamantane-2,9'-fluorene]-3'-ylphenyl)dibenzofuran-3-amine.
What is the SMILES notation for N,N-bis(4-phenylphenyl)-3-spiro[adamantane-2,9'-fluorene]-3'-ylaniline;9,9-dimethyl-N-(4-phenylphenyl)-N-(3-spiro[adamantane-2,9'-fluorene]-3'-ylphenyl)fluoren-2-amine;N-(4-phenylphenyl)-N-(3-spiro[adamantane-2,9'-fluorene]-3'-ylphenyl)dibenzofuran-3-amine?
The canonical SMILES for N,N-bis(4-phenylphenyl)-3-spiro[adamantane-2,9'-fluorene]-3'-ylaniline;9,9-dimethyl-N-(4-phenylphenyl)-N-(3-spiro[adamantane-2,9'-fluorene]-3'-ylphenyl)fluoren-2-amine;N-(4-phenylphenyl)-N-(3-spiro[adamantane-2,9'-fluorene]-3'-ylphenyl)dibenzofuran-3-amine is CC1(C)c2ccccc2-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3cccc(-c4ccc5c(c4)-c4ccccc4C54C5CC6CC(C5)CC4C6)c3)cc21.c1ccc(-c2ccc(N(c3ccc(-c4ccccc4)cc3)c3cccc(-c4ccc5c(c4)-c4ccccc4C54C5CC6CC(C5)CC4C6)c3)cc2)cc1.c1ccc(-c2ccc(N(c3cccc(-c4ccc5c(c4)-c4ccccc4C54C5CC6CC(C5)CC4C6)c3)c3ccc4c(c3)oc3ccccc34)cc2)cc1.
What is the InChIKey of N,N-bis(4-phenylphenyl)-3-spiro[adamantane-2,9'-fluorene]-3'-ylaniline;9,9-dimethyl-N-(4-phenylphenyl)-N-(3-spiro[adamantane-2,9'-fluorene]-3'-ylphenyl)fluoren-2-amine;N-(4-phenylphenyl)-N-(3-spiro[adamantane-2,9'-fluorene]-3'-ylphenyl)dibenzofuran-3-amine?
The InChIKey is ZTBXKQZNANNZHB-UHFFFAOYSA-N. The full InChI is InChI=1S/C55H47N.C52H41NO.C52H43N/c1-54(2)50-17-8-6-15-46(50)48-25-24-45(34-53(48)54)56(43-22-19-38(20-23-43)37-11-4-3-5-12-37)44-14-10-13-39(32-44)40-21-26-52-49(33-40)47-16-7-9-18-51(47)55(52)41-28-35-27-36(30-41)31-42(55)29-35;1-2-9-35(10-3-1)36-17-20-41(21-18-36)53(43-22-23-46-45-14-5-7-16-50(45)54-51(46)32-43)42-12-8-11-37(30-42)38-19-24-49-47(31-38)44-13-4-6-15-48(44)52(49)39-26-33-25-34(28-39)29-40(52)27-33;1-3-10-37(11-4-1)39-18-23-45(24-19-39)53(46-25-20-40(21-26-46)38-12-5-2-6-13-38)47-15-9-14-41(33-47)42-22-27-51-49(34-42)48-16-7-8-17-50(48)52(51)43-29-35-28-36(31-43)32-44(52)30-35/h3-26,32-36,41-42H,27-31H2,1-2H3;1-24,30-34,39-40H,25-29H2;1-27,33-36,43-44H,28-32H2.
What are the key properties of N,N-bis(4-phenylphenyl)-3-spiro[adamantane-2,9'-fluorene]-3'-ylaniline;9,9-dimethyl-N-(4-phenylphenyl)-N-(3-spiro[adamantane-2,9'-fluorene]-3'-ylphenyl)fluoren-2-amine;N-(4-phenylphenyl)-N-(3-spiro[adamantane-2,9'-fluorene]-3'-ylphenyl)dibenzofuran-3-amine?
N,N-bis(4-phenylphenyl)-3-spiro[adamantane-2,9'-fluorene]-3'-ylaniline;9,9-dimethyl-N-(4-phenylphenyl)-N-(3-spiro[adamantane-2,9'-fluorene]-3'-ylphenyl)fluoren-2-amine;N-(4-phenylphenyl)-N-(3-spiro[adamantane-2,9'-fluorene]-3'-ylphenyl)dibenzofuran-3-amine has a molecular weight of 2099.82 g/mol, XLogP of 42.51, 16 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-bis(4-phenylphenyl)-3-spiro[adamantane-2,9'-fluorene]-3'-ylaniline;9,9-dimethyl-N-(4-phenylphenyl)-N-(3-spiro[adamantane-2,9'-fluorene]-3'-ylphenyl)fluoren-2-amine;N-(4-phenylphenyl)-N-(3-spiro[adamantane-2,9'-fluorene]-3'-ylphenyl)dibenzofuran-3-amine is sourced from PubChem (CID 162212897), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).